4-Methoxybenzaldehyde

123-11-5

P-ANISALDEHYDE

Anisic aldehyde

Anisaldehyde

p-Methoxybenzaldehyde

Aubepine

4-Anisaldehyde

Benzaldehyde, 4-methoxy-

p-Formylanisole

Crategine

Obepin

p-Anisic aldehyde

para-anisaldehyde

4-Methoxy-benzaldehyde

Formylanisole, p-

anisal

Caswell No. 051E

FEMA No. 2670

NSC 5590

CCRIS 821

4-methoxy benzaldehyde

MFCD00003385

para-methoxybenzaldehyde

p-Methoxybenzaldehyde (natural)

HSDB 2641

EINECS 204-602-6

UNII-9PA5V6656V

p-methoxy benzaldehyde

DTXSID2026997

AI3-00223

9PA5V6656V

NSC-5590

50984-52-6

p-Methoxybenzaldehyde-13C6

CHEMBL161598

DTXCID906997

CHEBI:28235

EC 204-602-6

P-ANISALDEHYDE (USP-RS)

P-ANISALDEHYDE [USP-RS]

p-Anisaldehyde,p-Methoxybenzaldhyde

CAS-123-11-5

MEPYRAMINE MALEATE IMPURITY P (EP IMPURITY)

MEPYRAMINE MALEATE IMPURITY P [EP IMPURITY]

anisaldehyd

Anis aldehyde

FEMA 2670

4-methoxybenzaldehye

4-methoxybezaldehyde

EINECS 256-891-3

Anisaldehyde (para)

P-Anisaldehyde,(S)

4-methoxylbenzaldehyde

p-Anisaldehyde, 8CI

4-methoxybenzylaldehyde

BRN 0471382

p-Anisaldehyde, 98%

p-Anisaldehyde, Reagent

benzaldehyde, 4-methoxy

para-methoxy benzaldehyde

4-(methyloxy)benzaldehyde

bmse010130

WLN: VHR DO1

ANISALDEHYDE [INCI]

SCHEMBL1100

P-ANISALDEHYDE [MI]

68894-36-0

MLS002152921

P-ANISALDEHYDE [HSDB]

p-Methoxybenzylidenemalonitrile

4-methoxybenzene carboxaldehyde

PARA- METHOXYBENZALDEHYDE

NSC5590

HMS3039F08

p-Anisaldehyde, analytical standard

P-METHOXYBENZALDEHYDE [FCC]

HY-Y0740

p-Anisaldehyde, natural, 98%, FG

P-METHOXYBENZALDEHYDE [FHFI]

Tox21_201943

Tox21_303331

AC7808

BDBM50139370

s5086

STL194068

AKOS000118814

CCG-214805

CS-W020189

MCULE-9537754812

p-Anisaldehyde (4-Methoxybenzaldehyde)

p-Anisaldehyde, for synthesis, 98.0%

NCGC00090807-01

NCGC00090807-02

NCGC00257076-01

NCGC00259492-01

p-Anisaldehyde, >=97.5%, FCC, FG

AC-10379

CS-11005

SMR001224521

SY001689

DB-012818

A0480

BENZALDEHYDE,4-METHOXY MFC8 H8 O2

NS00003331

EN300-16096

4-08-00-00252 (Beilstein Handbook Reference)

A805017

Q174937

Q-100105

Z53833125

F2190-0575

p-Anisaldehyde, primary pharmaceutical reference standard

p-Anisaldehyde, certified reference material, TraceCERT(R)

p-Anisaldehyde, United States Pharmacopeia (USP) Reference Standard

InChI=1/C8H8O2/c1-10-8-4-2-7(6-9)3-5-8/h2-6H,1H

The Henry's Law constant for p-anisaldehyde is estimated as 1.4X10-5 atm-cu m/mole(SRC) derived from its vapor pressure, 3.29X10-2 mm Hg(1), and water solubility, 4.29X10+3 mg/L(2). This Henry's Law constant indicates that p-anisaldehyde is expected to volatilize from water surfaces(3). Based on this Henry's Law constant, the volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec)(3) is estimated as 20 days(SRC). The volatilization half-life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec)(3) is estimated as 230 days(SRC). p-Anisaldehyde's estimated Henry's Law constant indicates that volatilization from moist soil surfaces may occur(SRC). p-Anisaldehyde has a vapor pressure of 3.29X10-2 mm Hg at 25 °C(1) and exists as a liquid under environmental conditions; therefore, p-anisaldehyde may volatilize from dry soil(SRC).

The Koc of p-anisaldehyde is estimated as 53(SRC), using a log Kow of 1.76(1) and a regression-derived equation(2). According to a classification scheme(3), this estimated Koc value suggests that p-anisaldehyde is expected to have high mobility in soil.

2,5-DIMETHYLBENZALDEHYDE

5779-94-2

Isoxylaldehyde

Benzaldehyde, 2,5-dimethyl-

MFCD00003342

6M224X1615

UNII-6M224X1615

EINECS 227-303-2

2,5-dimethyl benzaldehyde

YSWG666

SCHEMBL268706

DTXSID0075449

2,5-Dimethylbenzaldehyde, 99%

CHEBI:173203

AKOS000120289

MCULE-9026398948

AC-28485

AS-58131

SY017911

DB-024140

CS-0153345

NS00033792

EN300-20658

A831605

W-105442

Q27265131

Z104479610

InChI=1/C9H10O/c1-7-3-4-8(2)9(5-7)6-10/h3-6H,1-2H

benzaldehyde

100-52-7

Benzoic aldehyde

Phenylmethanal

Benzenecarboxaldehyde

Benzenecarbonal

Benzenemethylal

Benzaldehyde FFC

Benzene carbaldehyde

Benzene carboxaldehyde

benzanoaldehyde

Benzylaldehyde

Benzoyl hydride

NCI-C56133

Benzoic acid aldehyde

FEMA No. 2127

Caswell No. 076

Phenylformaldehyde

Benzaldehyde (natural)

NSC 7917

Benzadehyde

Benzyaldehyde

CCRIS 2376

HSDB 388

NSC-7917

EINECS 202-860-4

UNII-TA269SD04T

Benzaldehyde-carbonyl-13C

Benzaldehyde [NF]

EPA Pesticide Chemical Code 008601

Benzaldehyde-formyl-d

TA269SD04T

Benzaldehyde-alpha-d1

DTXSID8039241

CHEBI:17169

AI3-09931

MFCD00003299

8013-76-1

Benzaldehyde, methyl-

CHEMBL15972

DTXCID90134

NSC7917

EC 202-860-4

Phenylmethanal benzenecarboxaldehyde

Benzaldehyde (NF)

NCGC00091819-01

NCGC00091819-02

BENZALDEHYDE (II)

BENZALDEHYDE [II]

BENZALDEHYDE (MART.)

BENZALDEHYDE [MART.]

benzaldehyd

Benzaldhyde

BENZALDEHYDE (USP IMPURITY)

BENZALDEHYDE [USP IMPURITY]

BDBM50139371

CAS-100-52-7

FENTANYL IMPURITY E (EP IMPURITY)

FENTANYL IMPURITY E [EP IMPURITY]

TRIBENOSIDE IMPURITY C (EP IMPURITY)

TRIBENOSIDE IMPURITY C [EP IMPURITY]

BENZYL ALCOHOL IMPURITY A (EP IMPURITY)

BENZYL ALCOHOL IMPURITY A [EP IMPURITY]

FENTANYL CITRATE IMPURITY E (EP IMPURITY)

FENTANYL CITRATE IMPURITY E [EP IMPURITY]

AMFETAMINE SULFATE IMPURITY D (EP IMPURITY)

AMFETAMINE SULFATE IMPURITY D [EP IMPURITY]

UN1990

BENZALKONIUM CHLORIDE IMPURITY B (EP IMPURITY)

BENZALKONIUM CHLORIDE IMPURITY B [EP IMPURITY]

GLYCOPYRRONIUM BROMIDE IMPURITY F (EP IMPURITY)

GLYCOPYRRONIUM BROMIDE IMPURITY F [EP IMPURITY]

HYDROUS BENZOYL PEROXIDE IMPURITY A (EP IMPURITY)

HYDROUS BENZOYL PEROXIDE IMPURITY A [EP IMPURITY]

benzaidehyde

benzaldehvde

benzaldehye

benzaldeyde

BENZOYLL PEROXIDE HYDROUS IMPURITY A (EP IMPURITY)

BENZOYLL PEROXIDE HYDROUS IMPURITY A [EP IMPURITY]

C7H6O

phenyl-methanone

Benzene methylal

Aromatic aldehyde

Benzoylwasserstoff

(phenyl)methanone

benzenecarbaldehyde

Benzaldehyde,(S)

PhCHO

Benzene carcaboxaldehyde

2vj1

WLN: VHR

BENZALDEHYDE [MI]

SCHEMBL573

BENZALDEHYDE [FCC]

BENZALDEHYDE [FHFI]

BENZALDEHYDE [HSDB]

BENZALDEHYDE [INCI]

BENZALDEHYDE [VANDF]

ghl.PD_Mitscher_leg0.170

BENZALDEHYDE [USP-RS]

Benzaldehyde, AR, >=99%

Benzaldehyde, LR, >=99%

BIDD:ER0249

BDBM60953

Benzaldehyde, analytical standard

Ald3-H_000012

Benzaldehyde, >=98%, FG, FCC

Ald3.1-H_000160

Ald3.1-H_000479

Ald3.1-H_000798

Tox21_113069

Tox21_113244

Tox21_200634

s5574

STL194067

Benzaldehyde, for synthesis, 95.0%

AKOS000119172

Benzaldehyde [UN1990] [Class 9]

CCG-266041

MCULE-7744113682

NA 1989

Benzaldehyde, purum, >=98.0% (GC)

Benzaldehyde, ReagentPlus(R), >=99%

NCGC00091819-03

NCGC00258188-01

PS-11959

Benzaldehyde, natural, >=98%, FCC, FG

DB-023673

B2379

Benzaldehyde, SAJ special grade, >=98.0%

NS00008510

Benzaldehyde, Vetec(TM) reagent grade, 98%

Benzaldehyde 1000 microg/mL in Dichloromethane

Benzaldehyde 2000 microg/mL in Dichloromethane

Benzaldehyde, puriss. p.a., >=99.0% (GC)

C00193

C00261

D02314

A800226

Q372524

SR-01000944375

Benzaldehyde, purified by redistillation, >=99.5%

SR-01000944375-1

F1294-0144

Flavor and Extract Manufacturers' Association No. 2127

InChI=1/C7H6O/c8-6-7-4-2-1-3-5-7/h1-6

Benzaldehyde, European Pharmacopoeia (EP) Reference Standard

Benzaldehyde, United States Pharmacopeia (USP) Reference Standard

Benzaldehyde, Pharmaceutical Secondary Standard; Certified Reference Material

The Henry's Law constant for benzaldehyde is 2.67X10-5 atm-cu m/mole(1). This Henry's Law constant indicates that benzaldehyde is expected to volatilize from water surfaces(2). Based on this Henry's Law constant, the volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec)(2) is estimated as 1.5 days (SRC). The volatilization half-life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec)(2) is estimated as 14 days(SRC). Benzaldehyde's Henry's Law constant indicates that volatilization from moist soil surfaces may occur(SRC). Benzaldehyde is expected to volatilize from dry soil surfaces(SRC) based upon a vapor pressure of 1.27 mm Hg at 25 deg C(3).
Literature: (1) Betterton EA, Hoffmann MR; Environ Sci Technol 22: 1415-8 (1988) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990) (3) Ambrose D et al; J Chem Therm 7: 1143-57 (1975)

Using a structure estimation method based on molecular connectivity indices(1), the Koc of benzaldehyde can be estimated to be 11(SRC). According to a classification scheme(2), this estimated Koc value suggests that benzaldehyde is expected to have very high mobility in soil.
Literature: (1) US EPA; Estimation Program Interface (EPI) Suite. Ver. 4.1. Nov, 2012. Available from, as of May 30, 2016: http://www2.epa.gov/tsca-screening-tools/ (2) Swann RL et al; Res Rev 85: 17-28 (1983)

2-Phenyl-2-propanol

2-Phenylpropan-2-ol

617-94-7

Dimethylphenylcarbinol

1-Hydroxycumene

Dimethylphenylmethanol

2-PHENYLISOPROPANOL

alpha-Cumyl alcohol

alpha,alpha-Dimethylbenzyl alcohol

Phenyldimethylcarbinol

2-Propanol, 2-phenyl-

2-phenyl-propan-2-ol

Dimethyl phenyl carbinol

alpha,alpha-Dimethylbenzenemethanol

a,a-dimethylbenzyl alcohol

NSC 1261

Benzyl alcohol, alpha,alpha-dimethyl-

Benzenemethanol, alpha,alpha-dimethyl-

NSC 212537

.alpha.-Cumyl alcohol

Benzenemethanol, .alpha.,.alpha.-dimethyl-

MFCD00004456

.alpha.,.alpha.-Dimethylbenzyl alcohol

Benzyl alcohol, .alpha.,.alpha.-dimethyl-

JE030BGE05

DTXSID3027247

NSC-1261

NSC-212537

Benzyl alcohol,.alpha.-dimethyl-

Benzenemethanol,.alpha.-dimethyl-

2-phenylpropanol-2

HSDB 5718

EINECS 210-539-5

BRN 1905012

UNII-JE030BGE05

AI3-05532

dimethylphenyl carbinol

2-Phenylisopropyl alcohol

1-Methyl-1-phenylethanol

2-Hydroxy-2-phenylpropane

EC 210-539-5

4-06-00-03219 (Beilstein Handbook Reference)

SCHEMBL164244

2-Phenyl-2-propanol, 97%

DTXCID107247

CHEMBL3185495

alpha,alpha-dimethylbenzyl aldohol

NSC1261

(1-hydroxy-1-methylethyl)benzene

CHEBI:131607

2-PHENYLISOPROPANOL [HSDB]

AMY25731

STR08958

Tox21_200449

NSC212537

AKOS009158102

CS-W016526

HY-W015810

MCULE-1685813708

PB47644

PS-4036

.alpha.,.alpha.-Dimethylbenzenemethanol

NCGC00248623-01

NCGC00258003-01

CAS-617-94-7

SY021550

NS00010783

P0213

BENZENEMETHANOL, ALPHA, ALPHA, DIMETHYL

EN300-120905

P15346

A868634

W-105093

Q15726116

InChI=1/C9H12O/c1-9(2,10)8-6-4-3-5-7-8/h3-7,10H,1-2H

The Henry's Law constant for 2-phenylisopropanol is estimated as 3.8X10-7 atm-cu m/mole(SRC) using a fragment constant estimation method(1). This value indicates that 2-phenylisopropanol will be essentially nonvolatile from water surfaces(2,SRC). 2-Phenylisopropanol's vapor pressure, 0.047 mm Hg(3,SRC) indicates that volatilization from dry soil surfaces may occur. However, 2-phenylisopropanol's Henry's Law constant(1,SRC) indicates that volatilization from moist soil may not occur(SRC).
Literature: (1) Meylan WM, Howard PH; Environ Toxicol Chem 10: 1283-93 (1991) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington DC: Amer Chem Soc pp. 15-1 to 15-29 (1990) (3) Lyman WJ; p 31 in Environmental Exposure From Chemicals Vol I, Neely WB, Blau GE(eds), Boca Raton, FL: CRC Press (1985)

INSOL IN WATER; SOL IN ETHANOL, ETHER, BENZENE
Literature: Lide, D.R. (ed.). CRC Handbook of Chemistry and Physics. 75th ed. Boca Raton, Fl: CRC Press Inc., 1994-1995., p. 3-52

Using a structure estimation method based on molecular connectivity indexes(1), the Koc for 2-phenylisopropanol can be estimated to be about 36(SRC). The Koc of 2-phenylisopropanol can also be estimated to be approximately 274(SRC), using an estimated log Kow of 1.95(2,SRC) and a regression-derived equation(3,SRC). According to a recommended classification scheme(4), these estimated Koc values suggest that 2-phenylisopropanol has very high to medium mobility in soil(SRC).
Literature: (1) Meylan WM et al; Environ Sci Technol 28: 459-65 (1992) (2) Meylan WM, Howard PH; J Pharm Sci 84: 83-92 (1995) (3) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington DC: Amer Chem Soc pp. 4-9 (1990) (4) Swann RL et al; Res Rev 85: 23 (1983)

alpha-Calacorene

21391-99-1

(S)-1-Isopropyl-4,7-dimethyl-1,2-dihydronaphthalene

(1S)-4,7-dimethyl-1-propan-2-yl-1,2-dihydronaphthalene

(1S)-4,7-dimethyl-1-(propan-2-yl)-1,2-dihydronaphthalene

DTXSID201020798

CALAMENENE

cis-Calamenene

483-77-2

72937-55-4

(+/-)-Cadina-1,3,5-triene

Calamenene, cis-(+/-)-

5C6W67N6XM

Naphthalene, 1,2,3,4-tetrahydro-1,6-dimethyl-4-(1-methylethyl)-, (1S-cis)-

R8O22WBF8L

UNII-5C6W67N6XM

(1S,4S)-1,6-dimethyl-4-propan-2-yl-1,2,3,4-tetrahydronaphthalene

(-)-Calamenene

Naphthalene, 1,2,3,4-tetrahydro-1,6-dimethyl-4-(1-methylethyl)-, (1R,4R)-rel-

(Z)-calamenene

1-S-cis-Calamenene

Cadina-1,3,5-triene

1S-CIS-CALAMENENE

UNII-R8O22WBF8L

CALAMENENE, (-)-

(1S,4S)-4-Isopropyl-1,6-dimethyl-1,2,3,4-tetrahydronaphthalene

(1S,4S)-1,6-dimethyl-4-(propan-2-yl)-1,2,3,4-tetrahydronaphthalene

CALAMENENE, CIS-(-)-

IT SHOULD BE NOTED THAT cis-calamenene is eluted late vs trans-calamenene

DTXSID40880702

CHEBI:218611

PGTJIOWQJWHTJJ-STQMWFEESA-N

DTXSID501042907

(-)-CADINA-1,3,5-TRIENE

NS00095902

Q63398612

(1S-cis)-1,6-Dimethyl-4-(1-methylethyl)-1,2,3,4-tetrahydronaphthalene

1,2,3,4-tetrahydro-1,6-dimethyl-4(1-methylethyl)-(1s-cis)-naphthalene

Rel-(1S,4S)-4-isopropyl-1,6-dimethyl-1,2,3,4-tetrahydronaphthalene

(1S,4S)-1,2,3,4-TETRAHYDRO-1,6-DIMETHYL-4-(1-METHYLETHYL)NAPHTHALENE

naphthalene, 1,2,3,4-tetrahydro-1,6-dimethyl-4- (1-methylethyl)-, (1S-cis)-

NAPHTHALENE, 1,6-DIMETHYL-4-(1-METHYLETHYL)-1,2,3,4-TETRAHYDRO-, (1S-Z)-

2-ETHYL-3,5-DIMETHYLPYRAZINE

13925-07-0

3,5-Dimethyl-2-ethylpyrazine

Pyrazine, 2-ethyl-3,5-dimethyl-

27043-05-6

3-Ethyl-2,6-dimethylpyrazine

55031-15-7

2,6-Dimethyl-3-ethylpyrazine

FEMA 3150

2-Ethyl-3,5(6)-dimethylpyrazine

2-Ethyl-3,5-dimethyl pyrazine

Pyrazine, 2,6-dimethyl-3-ethyl-

Pyrazine, 3,5-dimethyl-2-ethyl-

R182EY5L8C

Pyrazine, 3-ethyl-2,6-dimethyl

2-Ethyl-3,5(6)-dimethyl-pyrazine

2-Ethyl-3,5-dimethylpyrazine (contains 2-Ethyl-3,6-dimethylpyrazine)

3,5-cocoa pyrazine

EINECS 237-694-1

BRN 0636984

UNII-R182EY5L8C

2-Ethyl-3,5(or 3,6)-dimethylpyrazine

starbld0003492

98%, mixture of isomers

5-23-05-00440 (Beilstein Handbook Reference)

MLS000517293

SCHEMBL108874

CHEMBL328856

2,6-Dimethyl-3-ethyl-Pyrazine

3,5-Dimethyl-2-ethyl-Pyrazine

DTXSID7065679

FEMA NO. 3150

CHEBI:193645

2-Ethyl-3(5or6)-dimethylpyrazine

MFCD00047392

MFCD29918847

AKOS015899029

ETHYL-2,6-DIMETHYLPYRAZINE, 3-

AS-50065

SMR000127410

DB-003267

DB-047143

CS-0018028

E1424

NS00012399

3-ETHYL-2,6-DIMETHYLPYRAZINE [FHFI]

O10767

2-ethyl-3,5(6)-dimethyl-pyrazine, AldrichCPR

A886096

W-107134

W-108220

Q27287651

CADALENE

Cadalin

483-78-3

4-Isopropyl-1,6-dimethylnaphthalene

1,6-dimethyl-4-propan-2-ylnaphthalene

Naphthalene, 1,6-dimethyl-4-(1-methylethyl)-

Naphthalene, 4-isopropyl-1,6-dimethyl-

1,6-Dimethyl-4-(1-methylethyl)naphthalene

49X2436USB

UNII-49X2436USB

CADALENE [MI]

CHEBI:89476

DTXSID40197483

VMOJIHDTVZTGDO-UHFFFAOYSA-N

1,6-dimethyl-4-isopropylnaphthalene

1,6-Dimethyl-4-isopropylnaphthaIene

AKOS006280705

LMPR0103330007

4-(1-methylethyl)-1,6-dimethylnaphthalene

1,6-dimethyl-4-(1-methylethyl) naphthalene

1,6-dimethyl-4-(1-methylethyl)-naphthalene

NS00031790

Q2692437

3-ETHYLPHENOL

620-17-7

m-Ethylphenol

Phenol, 3-ethyl-

Phenol, m-ethyl-

1-Ethyl-3-hydroxybenzene

1-Hydroxy-3-ethylbenzene

meta-Ethylphenol

3-Ethyl-phenol

3-ETHYL PHENOL

MFCD00002311

0G9ZK222JX

DTXSID0022480

CHEBI:34332

NSC-8873

3-Ethylphenol 100 microg/mL in Methanol

DTXCID402480

CAS-620-17-7

Benzene, 1-ethyl-3-hydroxy-

HSDB 5720

NSC 8873

EINECS 210-627-3

UNII-0G9ZK222JX

AI3-19938

m-Ethyl phenol

Isobutylsalicylate

3-Ethylphenol, 99%

ETHYLPHENOL, 3-

SCHEMBL51757

3-ETHYLPHENOL [HSDB]

BIDD:ER0180

CHEMBL58052

NSC8873

Tox21_201623

Tox21_302992

STL481945

3-Ethylphenol, >=95.0% (GC)

3-Ethylphenol, technical grade, 80%

AKOS000120810

MCULE-6091136568

NCGC00249086-01

NCGC00256388-01

NCGC00259172-01

LS-09015

SY026494

DB-030920

A8582

E0161

NS00010664

EN300-20883

D78431

3-Ethylphenol, PESTANAL(R), analytical standard

Q-200377

Q4634135

InChI=1/C8H10O/c1-2-7-4-3-5-8(9)6-7/h3-6,9H,2H2,1H

The Henry's Law constant for 3-ethylphenol is estimated as 1.1X10-6 atm-cu m/mole(SRC) using a fragment constant estimation method(1). This value indicates that 3-ethylphenol will volatilize from water surfaces(2,SRC). Based on this Henry's Law constant, the volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec) is estimated as approximately 37 days(2,SRC). The volatilization half-life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec) is estimated as approximately 274 days(2,SRC). 3-Ethylphenol's values for vapor pressure(4) and Henry's Law constant(1,SRC) indicate that volatilization from dry and moist soil surfaces is possible, but not likely to be a major fate process for this compound(SRC).
Literature: (1) Meylan WM, Howard PH; Environ Toxicol Chem 10: 1283-93 (1991) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington DC: Amer Chem Soc pp. 15-1 to 15-29 (1990) (3) Lyman WJ; p 31 in Environmental Exposure From Chemicals Vol I, Neely WB, Blau GE(eds), Boca Raton, FL: CRC Press (1985) (4) Biddiscombe DP et al; J Chem Soc. pp. 5764-8 (1963)

SLIGHTLY SOLUBLE IN WATER, CHLOROFORM; VERY SOLUBLE IN ALCOHOL, ETHER
Literature: Lide, D.R. (ed.). CRC Handbook of Chemistry and Physics. 75th ed. Boca Raton, Fl: CRC Press Inc., 1994-1995., p. 3-256

The Koc of 3-ethylphenol is estimated as approximately 480(SRC), using a measured log Kow of 2.40(1) and a regression-derived equation(2,SRC). According to a recommended classification scheme(3), this estimated Koc value suggests that 3-ethylphenol has moderate mobility in soil(SRC).
Literature: (1) Hansch C, Leo AJ; Pomona College Medicinal Chemistry Project. Claremont, CA. Log P Database (1987) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington DC: Amer Chem Soc pp. 4-9 (1990) (3) Swann RL et al; Res Rev 85: 23 (1983)

phenol

108-95-2

carbolic acid

Hydroxybenzene

Phenic acid

Oxybenzene

Benzenol

Phenylic acid

Phenylic alcohol

Monophenol

Phenyl hydrate

Phenyl hydroxide

PhOH

Monohydroxybenzene

Paoscle

Phenole

Izal

Phenyl alcohol

Phenol alcohol

Acide carbolique

Phenol, liquefied

Fenolo

Carbolsaure

Phenosmolin

Fenol

Liquid phenol

Phenol, pure

Benzene, hydroxy-

Rcra waste number U188

Liquefied phenol

Liquified Phenol

Carbolicum acidum

Fenolo [Italian]

NCI-C50124

Phenole [German]

Campho-Phenique Gel

phenylalcohol

UN 2312 (molten)

Phenol [JAN]

UN 1671 (solid)

Phenic

Carbolsaure [German]

Caswell No. 649

Campho-Phenique Liquid

Phenol, molten

2-allphenol

Baker's P & S liquid & Ointment

Fenol [Dutch, Polish]

NSC 36808

Phenol, liquified

Baker's P and S Liquid and Ointment

Monohydroxy benzene

Acide carbolique [French]

CCRIS 504

Campho-Phenique Cold Sore Gel

Carbolsaeure

FEMA No. 3223

Karbolsaeure

HSDB 113

Phenoxy

acide phenique

DTXSID5021124

Phenic alcohol

Phenol,liquified

Synthetic phenol

Phenol, dimer

AI3-01814

RCRA waste no. U188

EINECS 203-632-7

UNII-339NCG44TV

MFCD00002143

NSC-36808

UN1671

UN2312

UN2821

EPA Pesticide Chemical Code 064001

339NCG44TV

CHEBI:15882

Phenol [USP:JAN]

ENT-1814

27073-41-2

CHEMBL14060

DTXCID501124

EC 203-632-7

NSC36808

Phenol, Glass Distilled Under Argon

65996-83-0

Phenol, solid [UN1671] [Poison]

Phenol (USP:JAN)

Phenol, molten [UN2312] [Poison]

NCGC00091454-04

Fenosmoline

Fenosmolin

PHENOL (IARC)

PHENOL [IARC]

PHENOL (USP-RS)

PHENOL [USP-RS]

PHENOL (II)

PHENOL [II]

PHENOL (MART.)

PHENOL [MART.]

Phenol, >=99.0%

17442-59-0

PHENOL (EP MONOGRAPH)

PHENOL [EP MONOGRAPH]

PHENOL (USP MONOGRAPH)

PHENOL [USP MONOGRAPH]

Phen-2,4,6-d3-ol-d

Carbol

hydroxy benzene

Phenol 100 microg/mL in Methanol

Phenol, liquid

Phenol, solid

Baker's p and s

Phenol, sulfurated

CAS-108-95-2

METACRESOL IMPURITY A (EP IMPURITY)

METACRESOL IMPURITY A [EP IMPURITY]

(14C)Phenol

HEXYLRESORCINOL IMPURITY A (EP IMPURITY)

HEXYLRESORCINOL IMPURITY A [EP IMPURITY]

PHENOL (2,3,4,5,6-D5)

arenols

Benzophenol

Karbolsaure

Phylorinol

Ulcerease

Hydroxy-benzene

Phenol liquid

Phenol molten

Fungus Fighte

Phenol synthetic

Pandy's reagent

Cepastat lozenges

Fortinia ID

Phenol, labeled with carbon-14

Acidum Carbolicum

Phenol (liquid)

2-phenyl alcohol

Sore ThroatCherry

Phenol, synthetic

Phenol, ultrapure

ABC Sore Throat

HEB Sore Throat

Phenol ACS grade

RugbyCherry Flavor

Sore ThroatMenthol

Sore Throat Spray

Meijer Sore Throat

Sore Throat Cherry

Sore Throat Relief

Liquefied phenol BP

Paoscle (TN)

Topcare Sore Throat

Carbolic acid liquid

Phenol (TN)

Phenol,(S)

TopCareCherry Flavor

Phenol, ACS reagent

PUBLIX Sore Throat

Carbolic acid, liquid

CepastatExtra Strength

Walgreens Sore Throat

63496-48-0

Sore ThroatReadyInCase

Vortex Moisturizer Oral

1ai7

1li2

4i7l

Liquefied phenol (TN)

DRx Choice Sore Throat

PHENOL [VANDF]

Wild Horse 777 Oral

PHENOL [FHFI]

PHENOL [HSDB]

PHENOL [INCI]

Sore Throat ReliefCherry

Castellani Paint 1.5%

Phenol (JP17/USP)

PHENOL [WHO-DD]

Phenol, detached crystals

Pain RelievingPetro Carbo

PHENOL [MI]

Phenol, >=99%

Sore Throat ReliefMenthol

WLN: QR

Good Neighbor Sore Throat

Liquefied phenol (JP17)

bmse000290

bmse010026

C6H5OH

Fenol(DUTCH, POLISH)

NICE SORE THROAT Cherry

PHENOL, 80% in ethanol

Phenol, LR, >=99%

HEB Sore ThroatCherry Flavor

MLS001065591

Phenol (CGA 73330)

Phenol, for molecular biology

BIDD:ER0293

Phenol for disinfection (TN)

ABC Sore ThroatMenthol Flavor

HEB Sore ThroatMenthol Flavor

NICE SORE THROAT Spearmint

Phenol, natural, 97%, FG

CHLORASEPTIC SORE THROAT

Chloraseptic Sore Throat Cherry

Chloraseptic Sore Throat Citrus

Cuticura pain relieving ointment

Sore Throat ReliefCherry Flavor

CARBOLICUM ACIDUM [HPUS]

DTXSID9075294

Phenol, AR, >=99.5%

PHENOL,LIQUIFIED [VANDF]

BDBM26187

CHEBI:33853

Phenol for disinfection (JP17)

Topcare Sore ThroatMenthol Flavor

3f39

Phenol 10 microg/mL in Methanol

PUBLIX Sore ThroatMenthol Flavor

Walgreens Sore ThroatCherry Flavor

phenol 0.6% anesthetic oral rinse

Tox21_113463

Tox21_201639

Tox21_300042

DRx Choice Sore ThroatMenthol Flavor

Phenol 5000 microg/mL in Methanol

STL194294

AKOS000119025

Eos Medicated Pain Relieving Lip Balm

Tox21_113463_1

DB03255

Good Neighbor Sore ThroatCherry Flavor

MCULE-9943948107

NA 2821

Phenol, BioXtra, >=99.5% (GC)

Phenol, SAJ first grade, >=98.0%

UN 1671

UN 2312

UN 2821

USEPA/OPP Pesticide Code: 064001

NCGC00091454-01

NCGC00091454-02

NCGC00091454-03

NCGC00091454-05

NCGC00091454-06

NCGC00091454-07

NCGC00254019-01

NCGC00259188-01

Phenol, JIS special grade, >=99.0%

61788-41-8

73607-76-8

AM802906

BP-30160

METHYL SALICYLATE IMPURITY B [EP]

SMR000568492

Phenol 1000 microg/mL in Dichloromethane

Phenol, PESTANAL(R), analytical standard

Liquified Phenol (contains 7-10 % water)

NS00010045

P1610

P2771

EN300-19432

C00146

D00033

Phenol, unstabilized, ReagentPlus(R), >=99%

SALICYLIC ACID IMPURITY C [EP IMPURITY]

Phenol, p.a., ACS reagent, 99.5-100.5%

PUBLIX Sore Throat Fast Relief Oral Anesthetic

Q130336

CVS Health Sore Throat Fast Relief Oral Anesthetic

J-610001

Phenol, for molecular biology, ~90% (T), liquid

A13-01814

F1908-0106

Phenol, unstabilized, purified by redistillation, >=99%

Z104473830

InChI=1/C6H6O/c7-6-4-2-1-3-5-6/h1-5,7

Phenol, BioUltra, for molecular biology, >=99.5% (GC)

Phenol, United States Pharmacopeia (USP) Reference Standard

Liquified Phenol, meets USP testing specifications, >=89.0%

Phenol, BioUltra, for molecular biology, TE-saturated, ~73% (T)

phenol;phenol [jan];phenol, pure;phenol phenol [jan] phenol, pure

Phenol, puriss. p.a., ACS reagent, reag. Ph. Eur., 99.0-100.5%

Phenol, contains hypophosphorous as stabilizer, loose crystals, ACS reagent, >=99.0%

Phenol, puriss., meets analytical specification of Ph. Eur., BP, USP, 99.5-100.5% (GC)

Phenol, puriss., meets analytical specification of Ph. Eur., BP, USP, >=99.5% (GC), crystalline (detached)

The Henry's Law constant for phenol is 3.33X10-7 atm-cu m/mol at 25 deg C(1). This Henry's Law constant indicates that phenol is expected to be essentially nonvolatile from water surfaces(2). Phenols's Henry's Law constant indicates that volatilization from moist soil surfaces in not expected to occur(SRC). Phenol is not expected to volatilize from dry soil surfaces(SRC) based upon a vapor pressure of 0.35 mm Hg(3).
Literature: (1) Gaffney JS et al; Environ Sci Technol 21: 519-23 (1987))(2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990) (3) Bingham E et al, eds; Patty's Toxicology. 5th ed. NY, NY: John Wiley & Sons Inc. 4: 383 (2001)

Phenol is reported to have low adsorptivity to clay soils and silt loam(1) and no adsorption to aquifer material(3) and montmorillonite and kaolinite clays(8). The Koc for phenol to a Batcombe silt loam soil (pH 6.7, organic carbon 2.51%) was 30(6). It was 16 for a Brookstone clay loam (pH 5.7, organic matter 5.1%) and varied with pH and iron content of the soil(7). The Freundlich K and (1/N) for phenol in Captina (pH 5.7, 1.1 % organic matter) and Palouse silt loam (pH 5.7, 3.6% organic matter) soils were 0.58 (1.15) and 0.81 (1.00)(2); the Koc values for these soils are 91 and 39(SRC). Based on the reported Koc values, phenol would be expected to generally exhibit very high mobility in soil, based on a classification scheme(4). In a study of the adsorption of phenol onto siltstone associated with a Wyoming coal deposit suitable for in situ gasification, the pH of the solution was the major controlling factor with adsorption occurring at pH's below the pKa of phenol and no adsorption occurring at pH's above the pKa(5). The log of the Freundlich K value was approximately -4(5). Therefore, phenol may be transported by groundwater near in situ coal gasification sites due to the elevated pH's at these sites after gasification(5). The pKa of phenol is 9.99(9), indicating that it will be partially dissociated at the upper end of environmental pH range and its mobility may be pH dependent(SRC). In general, anions generally do not adsorb to organic carbon and clay as strongly as their neutral counterparts(10).
Literature: (1) Artiola-Fortuny J, Fuller WH; Soil Sci 133: 18-26 (1982) (2) Scott HD et al; J Environ Qual 12: 91-5 (1983) (3) Ehrlich GG et al; Groundwater 20: 703-10 (1982) (4) Swann RL et al; Res Rev 85: 17-28 (1983) (5) Laquer FC, Manahan SE; Chemosphere 16: 1431-45 (1987) (6) Briggs GG; J Agric Food Chem 29: 1050-9 (1981) (7) Boyd SA et al; Appl Environ Microbiol 46: 50-4 (1983) (8) Luh MD, Baker RA; pp. 534-42 in Proc 25th Ind Waste Conf Purdue Univ (1970) (9) Lide DR, ed; CRC Handbook of Chemistry and Physics. 81st Ed. Boca Raton, FL: CRC Press LLC, p. 5-89 (2000) (10) Doucette WJ; pp. 141-188 in Handbook of Property Estimation Methods for Chemicals. Boethling RS, Mackay D, eds. Boca Raton, FL: Lewis Publ (2000)

eugenol

97-53-0

4-Allyl-2-methoxyphenol

4-Allylguaiacol

Eugenic acid

Allylguaiacol

p-Eugenol

Caryophyllic acid

p-Allylguaiacol

2-Methoxy-4-prop-2-enylphenol

2-Methoxy-4-allylphenol

Phenol, 2-methoxy-4-(2-propenyl)-

Engenol

1,3,4-Eugenol

2-Methoxy-4-(2-propenyl)phenol

5-Allylguaiacol

Synthetic eugenol

1-Hydroxy-2-methoxy-4-allylbenzene

4-Allylcatechol-2-methyl ether

2-Methoxy-1-hydroxy-4-allylbenzene

4-Allyl-1-hydroxy-2-methoxybenzene

bioxeda

1-Hydroxy-2-methoxy-4-prop-2-enylbenzene

2-methoxy-4-(prop-2-en-1-yl)phenol

2-Hydroxy-5-allylanisole

FEMA No. 2467

4-Hydroxy-3-methoxy-1-allylbenzene

4-Hydroxy-3-methoxyallylbenzene

2-Methoxy-4-(2-propen-1-yl)phenol

Eugenol (natural)

Phenol, 4-allyl-2-methoxy-

4-Allylcatechol 2-methyl ether

NCI-C50453

1-allyl-4-hydroxy-3-methoxybenzene

1-Allyl-3-methoxy-4-hydroxybenzene

Caswell No. 456BC

FEMA Number 2467

2-Metoksy-4-allilofenol

CCRIS 306

FA 100

CHEBI:4917

HSDB 210

NSC 209525

Caryophillic acid

NSC-8895

EINECS 202-589-1

Eugenol (USP)

Eugenol [USP]

EPA Pesticide Chemical Code 102701

NSC-209525

UNII-3T8H1794QW

BRN 1366759

DTXSID9020617

Phenol, 2-methoxy-4-(2-propen-1-yl)-

AI3-00086

3T8H1794QW

MFCD00008654

naturel

CHEMBL42710

DTXCID90617

2-Methoxy-4-(3-propenyl)phenol

2-methoxy-4-prop-2-enyl-phenol

EC 202-589-1

3-(3-methoxy-4-hydroxyphenyl)propene

NCGC00091449-05

EUGENOL (IARC)

EUGENOL [IARC]

EUGENOL (II)

EUGENOL [II]

EUGENOL (MART.)

EUGENOL [MART.]

EUGENOL (USP-RS)

EUGENOL [USP-RS]

Eugenol [USAN]

WLN: 1U2R DQ CO1

EUGENOL (EP MONOGRAPH)

EUGENOL [EP MONOGRAPH]

EUGENOL (USP MONOGRAPH)

EUGENOL [USP MONOGRAPH]

CAS-97-53-0

2-Metoksy-4-allilofenol [Polish]

SR-05000002043

allylguaicol

natural

naturale

oogenol

phenylpropanoid

redistillation

Eugenolum

fractionation,

animal feed

water white

Dentek Eugenol

alim ue

fami qs

Teething Gel

ugenol,

eugenic acid,

clove,

Isolate,

US Pharmacopoeia

Eugenol BP

flash distillation

clove oil fraction

Nuby Teething Gel

Eugenol,(S)

1-hydroxy-4-allyl-2-methoxybenzene

Red Cross Toothache

British Pharmacopoeia

clove oil terpeneless

eugenol for synthesis

Eugenol1518

4-allyl-2methoxyphenol

3s0e

EFEUF,

EUGENOL [VANDF]

EUGENOL [FHFI]

EUGENOL [HSDB]

EUGENOL [INCI]

Marshall Toothache Drops

4-allyl 2-methoxyphenol

EUGENOL [FCC]

EUGENOL [MI]

Spectrum2_001264

Spectrum3_000646

Spectrum4_001783

Spectrum5_000425

EUGENOL [WHO-DD]

4-allyl-2-methoxy-Phenol

bmse010053

Epitope ID:114091

Eugenol, puriss., 98%

AnaDent Childrens Kanka Gel

Eugenol Toothache Medication

SCHEMBL20361

BSPBio_002251

KBioGR_002327

MLS000028901

SEUGE0001

BIDD:ER0696

DivK1c_000692

SPECTRUM1500296

SPBio_001228

GTPL2425

HMS502C14

KBio1_000692

KBio3_001471

Eugenol, ReagentPlus(R), 99%

NSC8895

4-(2-Propenyl)-2-methoxyphenol

Eugenol, natural, >=98%, FG

NINDS_000692

Eugenol, >=98%, FCC, FG

HMS1920O08

HMS2091F09

Pharmakon1600-01500296

2-methoxy-4-(2-propenyl)-phenol

HY-N0337

Tox21_111134

Tox21_202040

Tox21_300105

BBL027721

BDBM50164168

CCG-38827

NSC209525

NSC757030

s4706

STL371304

Eugenol, tested according to Ph.Eur.

AKOS000121354

Tox21_111134_1

CS-7807

DB09086

FS-2702

NSC-757030

SDCCGMLS-0066578.P001

IDI1_000692

USEPA/OPP Pesticide Code: 102701

Eugenol 1000 microg/mL in Acetonitrile

NCGC00091449-01

NCGC00091449-02

NCGC00091449-03

NCGC00091449-04

NCGC00091449-06

NCGC00091449-07

NCGC00091449-08

NCGC00091449-10

NCGC00253915-01

NCGC00259589-01

AC-34149

Eugenol, Vetec(TM) reagent grade, 98%

SMR000059114

2-METHOXY-4-(2'-PROPENYL)PHENOL

SBI-0051381.P003

DB-261256

Eugenol, PESTANAL(R), analytical standard

A0232

NS00003629

EN300-16622

D04117

AB00051992_02

A845719

Eugenol, primary pharmaceutical reference standard

Q423357

Eugenol, certified reference material, TraceCERT(R)

Q-201105

SR-05000002043-1

SR-05000002043-2

BRD-K32977963-001-01-9

BRD-K32977963-001-03-5

Z56347226

EUGENOL (CONSTITUENT OF HOLY BASIL LEAF) [DSC]

Eugenol, European Pharmacopoeia (EP) Reference Standard

F0001-2306

2-methoxy-4-(prop-2-en-1-yl)phenol4-allyl-2-methoxyphenol

EUGENOL (CONSTITUENT OF CINNAMOMUM CASSIA BARK) [DSC]

EUGENOL (CONSTITUENT OF CINNAMOMUM VERUM BARK) [DSC]

Eugenol, United States Pharmacopeia (USP) Reference Standard

Eugenol, Pharmaceutical Secondary Standard; Certified Reference Material

InChI=1/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H