Results for:
PubChem ID: 9016

1,4-dimethoxybenzene

Mass-Spectra

Compound Details

Synonymous names
Dimethylether hydrochinonu
Dimethylhydroquinone ether
Dimethyl hydroquinone
Dimethylhydroquinone; Hydroquinone dimethyl ether
Dimethyl ether hydroquinone
HYDROQUINONE DIMETHYL ETHER
OHBQPCCCRFSCAX-UHFFFAOYSA-N
p-Dimethoxybenzene
p-Methoxyanisole
4-Methoxyanisole
Quinol dimethyl ether
Hydroquinone, dimethyl ether
Methyl p-methoxyphenyl ether
p-dimethoxy benzene
AC1Q4FES
Dimethylether hydrochinonu [Czech]
Methyl 4-methoxyphenyl ether
1,4-Dimethoxybenzene
AC1L1S4V
1,4-Dimethoxybenzol
SCHEMBL8489
4-Methoxyphenol, methyl ether
K896
KSC175M9L
1,4-Dimethoxybenzene, analytical standard
ACMC-1C1E3
NSC7483
USAF AN-9
1,4-dimethoxy benzene
1,4-dimethoxy-benzene
24WC6T6X0G
4-Methoxyanisole;Anisole, p-methoxy
BDBM36302
Benzene, p-dimethoxy-
BENZENE,1,4-DIMETHOXY
CTK0H5695
D0629
T7424
1,4-dimethoxy-benzen
Anisole, p-methoxy-
AS06962
LS-878
RP20443
STR02500
CCRIS 5920
HMS2270C23
HSDB 4259
UNII-24WC6T6X0G
ZINC388747
AK109309
BBL003611
CHEMBL1668604
DTXSID0022014
Jsp002876
NSC 7483
NSC-7483
OR034548
SBB060067
STK065405
ZB011683
2-Benzimidazolinone,3-bis(hydroxymethyl)-
Benzene,1,4-dimethoxy-
DSSTox_CID_2014
Hydroquinone dimethyl ether (1,4-Dimethoxybenzene)
USAF uctl-1791
AB1003116
AJ-20759
AN-23314
ANW-21298
DSSTox_GSID_22014
KB-10592
SCHEMBL12015220
ST2403009
TRA0083185
WLN: 1OR DO1
DSSTox_RID_76460
MFCD00008401
ZINC00388747
AI3-24139
DB-013768
RTR-033046
ST51046314
TL80073944
TR-033046
AKOS000119956
Benzene, 1,4-dimethoxy-
I14-7639
W-108072
Z53833835
FEMA No. 2386
FT-0606887
MLS002454408
SMR001252207
2-Benzimidazolinone, 1,3-bis(hydroxymethyl)
Tox21_201333
Tox21_302782
150-78-7
F1908-0181
MCULE-5232933383
NCGC00091220-01
NCGC00091220-02
NCGC00091220-03
NCGC00256564-01
NCGC00258885-01
WLN: T56 BNVNJ B1Q D1Q
1,4-Dimethoxybenzene, 99%, FG
CAS-150-78-7
EINECS 205-771-9
1,4-Dimethoxybenzene, ReagentPlus(R), 99%
MolPort-001-768-565
1,4-Dimethoxybenzene, Vetec(TM) reagent grade, 98%
HYDROQUINONE DIMETHYL ETHER (SEE ALSO: HYDROQUINONE MONOMETHYL ETHER (CAS 150-76-5))
InChI=1/C8H10O2/c1-9-7-3-5-8(10-2)6-4-7/h3-6H,1-2H
Microorganism:

Yes

IUPAC name1,4-dimethoxybenzene
SMILESCOC1=CC=C(C=C1)OC
InchiInChI=1S/C8H10O2/c1-9-7-3-5-8(10-2)6-4-7/h3-6H,1-2H3
FormulaC8H10O2
PubChem ID9016
Molweight138.166
LogP1.66
Atoms20
Bonds20
H-bond Acceptor2
H-bond Donor0
Chemical ClassificationBenzenoids Ethers

mVOC Specific Details

Volatilization
The Henry's Law constant for hydroquinone dimethyl ether is estimated as 3.5X10-3 atm-cu m/mole(1,SRC). This value indicates that hydroquinone dimethyl ether may 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) is estimated as approximately 4 hours(2,SRC). The volatilization half-life from a model lake (1 m deep) is estimated as approximately 5 days(2,SRC).
Literature: (1) Meylan W, 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 p. 15-1 to 15-29 (1990)
Soil Adsorption
Based on an experimental log Kow of 2.03(1), the Koc of hydroquinone dimethyl ether is estimated as approximately 300 using a regression-derived equation(2,SRC). According to a suggested classification scheme(3), this estimated Koc value suggests that hydroquinone dimethyl ether will have moderate mobility in soil(SRC).
Literature: (1) Hansch C et al; Exploring QSAR: Hydrophobic, Electronic, and Steric Constants. ACS Profess Ref Book, Washington,DC: Amer Chem Soc (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: 23 (1983)
Vapor Pressure
PressureReference
Vapor pressure: 8.7X10-2 mm Hg at 25 deg C(est)Lyman WJ; p 31 in Environmental Exposure From Chemicals Vol I, Neely WB, Blau GE(eds), Boca Raton, FL: CRC Press, p 31 (1985)
MS-Links

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaChondromyces Crocatusn/aSchulz and Dickschat, 2007
FungiTuber BrumaleFortywoodland of the Basilicata regionMauriello et al., 2004
BacteriaChondromyces Crocatus Cm C2n/aSchulz et al., 2004
BacteriaChondromyces Crocatus Cm C5n/aSchulz et al., 2004
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaChondromyces Crocatusn/an/a
FungiTuber Brumalemicroextraction–gas chromatography–mass spectrometry analysis (SPME–GC–MS)No
BacteriaChondromyces Crocatus Cm C2n/an/a
BacteriaChondromyces Crocatus Cm C5n/an/a