Benzeneacetonitrile

Phenylacetonitrile

Phenacetonitrile

alpha-phenylacetonitrile

benzylcyanide

Benzylkyanid

Benzylnitrile

benzene acetonitrile

benzene-acetonitrile

Phenyl-acetonitrile

alpha-Cyanotoluene

alpha-Tolunitrile

omega-Cyanotoluene

Phenylacetonitrile, liquid

SUSQOBVLVYHIEX-UHFFFAOYSA-N

2-Phenylacetonitrile

2-phenylethanenitrile

aceticacid,phenyl-nitrile

A-TOLUNITRILE

BENZYL CYANIDE

Benzyl nitrile

benzyl-cyanide

(Cyanomethyl)benzene

acetonitrile,phenyl-

Phenyl acetyl nitrile

2-phenyl-acetonitrile

AC1L1RPP

Benzyl cyanide, analytical standard

Acetonitrile, phenyl-

C8H7N

.alpha.-Cyanotoluene

.alpha.-Tolunitrile

.omega.-Cyanotoluene

AC1Q4S1D

Benzylkyanid [Czech]

METHYL, CYANOPHENYL-

Acetic acid, phenyl-nitrile

ACMC-1C0PN

BENZYL CYANIDE-13C

KSC175C3P

NSC3407

PubChem20468

SCHEMBL37831

UN2470

WLN: NC1R

Benzyl cyanide, >=99%

CTK0H5137

P0128

Toluene, alpha-cyano-

AS01366

Benzyl cyanide, 98%

LS-817

RP19286

USAF KF-21

23G40PRP93

C16074

CCRIS 4698

HSDB 2103

CHEMBL3560735

DTXSID2021492

NSC-3407

NSC118418

OR034299

OR218332

OR218333

OR286093

OR377898

SBB058386

UN 2470

A807640

CHEBI:25979

DSSTox_CID_1492

UNII-23G40PRP93

ZINC1666748

AN-23174

ANW-20559

CJ-26987

DEA Code 8735

DSSTox_GSID_21492

KB-47802

SC-26879

TRA0004632

DSSTox_RID_76184

MFCD00001894

ZINC01666748

AI3-04975

DB-004016

NSC 118418

NSC-118418

RTC-061401

ST51017243

AKOS000118943

J-519675

S01-0547

Toluene, .alpha.-cyano-

Z57131036

FT-0636686

FT-0657342

LABOTEST-BB LT00891699

OTAVA-BB 1519434

Tox21_200217

140-29-4

F0001-0481

MCULE-3500109780

NCGC00090854-01

NCGC00090854-02

NCGC00257771-01

CAS-140-29-4

EINECS 205-410-5

Phenylacetonitrile, liquid [UN2470] [Poison]

MolPort-001-768-890

Phenylacetonitrile, liquid [UN2470] [Poison]

InChI=1/C8H7N/c9-7-6-8-4-2-1-3-5-8/h1-5H,6H

The Henry's Law constant for benzyl cyanide is estimated as 1.4X10-4 atm-cu m/mole(SRC) derived from its vapor pressure, 8.9X10-2 mm Hg(1), and water solubility, 100 mg/L(2). This Henry's Law constant indicates that benzyl cyanide 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 5.7 hours(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 6.4 days(SRC). Benzyl cyanide's estimated Henry's Law constant indicates that volatilization from moist soil surfaces may occur(SRC). Benzyl cyanide is not expected to volatilize from dry soil surfaces(SRC) based upon its vapor pressure(1).
Literature: (1) O'Neil MJ, ed; The Merck Index. 13th ed Whitehouse Station, NJ: Merck and Co., Inc., p.194 (2001) (2) Chemicals Inspection and Testing Institute; Biodegradation and bioaccumulation data of existing chemicals based on the CSCL Japan. Japan Chemical Industry Ecology - Toxicology and Information Center. ISBN 4-89074-101-1 (1992) (3) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990)

The Koc of benzyl cyanide is estimated as 170(SRC), using a log Kow of 1.56(1) and a regression-derived equation(2). According to a classification scheme(3), this estimated Koc value suggests that benzyl cyanide is expected to have moderate mobility in soil.
Literature: (1) Hansch C et al; Exploring QSAR. Hydrophobic, Electronic, and Steric Constants. ACS Prof Ref Book. Heller SR, consult. ed., Washington, DC: Amer Chem Soc p. 39 (1995) (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: 17-28 (1983)

Cincholepidine

gamma-Methylquinoline

Lepidine

MUDSDYNRBDKLGK-UHFFFAOYSA-N

p-Methylquinoline

Lepidene

Lepidin

4-METHYLQUINOLINE

p-methyl quinoline

AC1L1UVN

AC1Q2RAJ

4-Lepidine

ACMC-1AHYH

.gamma.-Methylquinoline

4-methyl quinoline

4-methyl-quinoline

quinol-4-ylmethane

CHEMBL9734

L758

KSC235Q6N

NSC3412

Lepidine (4-Methylquinoline)

SCHEMBL31559

Lepidine, 99%

CTK1D5866

L0024

STR06140

RP20851

4-Methylquinoline, >=99%

CCRIS 2894

HSDB 7153

A22510

A15593

Quinoline, 4-methyl-

HE000809

HE345242

DTXSID7047067

SBB058784

NSC-3412

PS-3771

NSC 3412

M-5284

ZINC1666750

CHEBI:48983

CJ-26989

SC-12713

SC-15612

ST2413199

LS-87752

AJ-29036

DSSTox_GSID_47067

AK-49826

AN-21392

KB-39726

ANW-30727

BR-49826

DSSTox_RID_82083

DSSTox_CID_27067

Lepidine (6CI,8CI)

3S211042

MFCD00006784

3S110963

ZINC01666750

TC-020151

AI3-24277

ST50823863

DB-013319

TX-017072

116169T3O8

AKOS000119150

J-515822

FT-0627792

UNII-116169T3O8

FT-0659357

FT-0083296

BRN 0110926

Z966690984

Tox21_301829

491-35-0

NCGC00184238-02

MCULE-8999201921

NCGC00184238-01

NCGC00256086-01

NCGC00184238-03

NCGC00184238-04

NCGC00184238-05

NCGC00184238-06

NCGC00184238-07

NCGC00184238-08

NCGC00184238-09

NCGC00184238-10

CAS-491-35-0

EINECS 207-734-2

Quinoline, 4-methyl- (9CI)

MolPort-001-781-554

3007-43-0 (hydrochloride)

5-20-07-00389 (Beilstein Handbook Reference)

InChI=1/C10H9N/c1-8-6-7-11-10-5-3-2-4-9(8)10/h2-7H,1H

The Henry's Law constant for 4-methylquinoline is estimated as 7.6X10-7 atm-cu m/mole(SRC) using a fragment constant estimation method(1). This Henry's Law constant indicates that 4-methylquinoline is expected to be essentially nonvolatile from water surfaces(2). 4-Methylquinoline is not expected to volatilize from dry soil surfaces(SRC) based upon a vapor pressure of 6.4X10-3 mm Hg(3).
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) Walton J; Eng Sci Data Item 77019, p. 29 (1977)

Slightly soluble in water
Literature: Lide, DR (ed.). CRC Handbook of Chemistry and Physics. 81st Edition. CRC Press LLC, Boca Raton: FL 2000, p. 3-308
Literature: #Soluble in ethanol, ether, and acetone.
Literature: Lide, DR (ed.). CRC Handbook of Chemistry and Physics. 81st Edition. CRC Press LLC, Boca Raton: FL 2000, p. 3-308
Literature: #Miscible with alcohol and benzene
Literature: O'Neil, M.J. (ed.). The Merck Index - An Encyclopedia of Chemicals, Drugs, and Biologicals. 13th Edition, Whitehouse Station, NJ: Merck and Co., Inc., 2001., p. 973
Literature: #Soluble in mineral acid; insoluble in alkali
Literature: Lide, D.R., G.W.A. Milne (eds.). Handbook of Data on Organic Compounds. Volume I. 3rd ed. CRC Press, Inc. Boca Raton ,FL. 1994., p. V5 4875
Literature: #In water, 783 mg/liter @ 25 deg C
Literature: Meylan WM et al; Environ Toxicol Chem 15: 100-106 (1996)

The Koc of 4-methylquinoline is estimated as 630(SRC), using a log Kow of 2.61(1) and a regression-derived equation(2). According to a classification scheme(3), this estimated Koc value suggests that 4-methylquinoline is expected to have low mobility in soil(SRC). The pKa of 4-methylquinoline is 5.67(4), indicating that this compound will partially exist in cation form in the environment and cations generally adsorb to organic carbon and clay more strongly than their neutral counterparts(5).
Literature: (1) Hansch C et al; Exploring QSAR. Hydrophobic, Electronic, and Steric Constants. ACS Prof Ref Book. Heller SR, consult. ed., Washington, DC: Amer Chem Soc p. 68 (1995) (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: 17-28 (1983) (4) Perrin DD; Dissociation constants of organic bases in aqueous solution. IUPAC Chem Data Ser, Buttersworth, London (1965) (5) Doucette WJ; pp. 141-188 in Handbook of Property Estimation Methods for Chemicals. Boethling RS, Mackay D, eds. Boca Raton, FL: Lewis Publ (2000)

isoquinolinecarbonitrile

Isoquinaldonitrile

cyanoisoquinoline

1-Isoquinolinecarbonitrile

isoquinaldinic nitrile

HJHXYSBRTVFEDD-UHFFFAOYSA-N

1-Cyanoisoquinoline

1-isoquinoline carbonitrile

isoquinoline-1-carbonitrile

soquinoline-1-carbonitrile

1-cyano-isoquinoline

AC1Q4R1Q

AC1Q4R5A

AC1Q4R1R

ACMC-1BQ9Y

PubChem6269

1-cyanoisoquinoline 98%

AC1L782U

1-Isoquinolinecarbonitrile, 99%

RW3250

HMS547I02

X9400

CTK0I0414

CC-973

VQ10042

SCHEMBL251028

RP01845

AB03726

BIDD:GT0021

ACT01936

ZINC112431

NSC203335

ZB003770

STK774048

SBB002487

QC-2110

PS-5499

AM807134

HE240440

HE001040

S-3149

DTXSID20308378

BR-44707

CCG-45292

STOCK1S-02968

ANW-48030

ST4094265

ST2407058

SC-54250

AB0035124

AK-44707

AN-48849

AJ-11375

KB-11990

Maybridge1_002114

ZINC00112431

ZERO/005055

MFCD00134166

DB-004631

TC-136775

timtec-bb sbb002487

NSC-203335

W-205071

AKOS001295409

FT-0627508

EN300-25592

MCULE-7137840271

1198-30-7

125771-26-8

MolPort-000-514-719

AQ-776/40170967

SR-01000635070-1

4-phenylmethoxybenzenecarbonitrile

4-phenylmethoxybenzonitrile

4-Benzyloxybenzonitrile

UDAOJHAASAWVIQ-UHFFFAOYSA-N

4-(phenylmethoxy)benzenecarbonitrile

4-benzyloxy benzonitrile

4-Benzyloxy-benzonitrile

AC1LBO7L

4-cyanophenoxy phenyl methane

Benzonitrile analogue, 5a

AC1Q4RS5

4-(benzyloxy)benzonitrile

7472AB

OR4863

CTK1D4900

BDBM86781

HMS558H20

ZINC76272

ACMC-209l1v

SCHEMBL403151

FCH090097

CHEMBL2204754

CCG-1866

ZB002723

SBB094201

OR023934

A829259

K-9621

BC4133036

AX8094509

ANW-31553

AK-46888

CJ-00594

AJ-10379

AC-27866

KB-85922

ZX-AT011324

ZINC00076272

MFCD00079701

Maybridge1_005982

C-56649

Benzonitrile, 4-(phenylmethoxy)-

BBV-112390

ST50408391

TR-018707

Oprea1_847556

AKOS000113852

ACM52805364|1

FT-0617665

BB 0244138

I01-13362

MCULE-3806909478

52805-36-4

431946-37-1

MolPort-000-145-549