4-Methoxythioanisole - CAS 1879-16-9

Catalog:	BB014469
Product Name:	4-Methoxythioanisole
CAS:	1879-16-9
Synonyms:	1-methoxy-4-methylsulfanylbenzene

Technical Data

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Computed Properties

IUPAC Name:	1-methoxy-4-methylsulfanylbenzene
Description:	4-Methoxythioanisole (CAS# 1879-16-9) is a useful research chemical.
Molecular Weight:	154.23
Molecular Formula:	C8H10OS
Canonical SMILES:	COC1=CC=C(C=C1)SC
InChI:	InChI=1S/C8H10OS/c1-9-7-3-5-8(10-2)6-4-7/h3-6H,1-2H3
InChI Key:	DQNSKXYRRRCKGH-UHFFFAOYSA-N
Boiling Point:	99 °C (4 mmHg)
Density:	1.11 g/cm³
Appearance:	Colorless to yellow clear liquid
MDL:	MFCD00010587
LogP:	2.41710

Publication Number	Title	Priority Date
CN-113413917-A	Preparation and application of Tb-MOF nanosheet based on pyrenetetracarboxylic acid	20210602
CN-113304775-A	Surface chemical grafting graphene oxide supported molybdenum catalyst, preparation and application	20210508
CN-112410312-A	Cyclohexanone monooxygenase and application thereof	20201127
CN-111450818-A	Niobium pentoxide @ reduced graphene oxide catalyst and preparation method and application thereof	20200310
CN-111153837-A	Method for preparing sulfoxide compound by catalytic oxidation of thioether with nickel compound	20200117

PMID	Publication Date	Title	Journal
21708101	20110901	Prochelators triggered by hydrogen peroxide provide hexadentate iron coordination to impede oxidative stress	Journal of inorganic biochemistry
19633839	20100101	Sequence analysis and heterologous expression of a new cytochrome P450 monooxygenase from Rhodococcus sp. for asymmetric sulfoxidation	Applied microbiology and biotechnology
20355157	20090101	Screening for the calstabin-ryanodine receptor complex stabilizers JTV-519 and S-107 in doping control analysis	Drug testing and analysis
15568834	20041207	Conductometric, surface tension, and kinetic studies in mixed SDS-Tween 20 and SDS-SB3-12 micellar solutions	Langmuir : the ACS journal of surfaces and colloids
15303894	20040818	Tuning emissive states in electrogenerated chemiluminescence	Journal of the American Chemical Society

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Related Functional Groups

Sulfur Compounds

[123-43-3]
Sulfoacetic acid
[518012-62-9]
[2-[2-(2-Methoxyethoxy)ethoxy]ethoxy]p-toluenesulfonate
[2006276-82-8]
[3-(N,N-Dimethylsulfamoyl)phenyl]methanesulfonyl Chloride
[85-47-2]
1-Naphthalenesulfonic acid
[71996-48-0]
1-Methyl-2-[(phenylsulfonyl)methyl]benzene
[162894-76-0]
2-Hydroxyethane-1-sulfonamide

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GHS Hazard Statement:	H302 (97.56%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	87.3
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	154.04523611
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	154.04523611
Rotatable Bond Count:	2
Topological Polar Surface Area:	34.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.7