CAS 1879-16-9 | Benzene, 1-methoxy-4-(methylthio)- | CAS Number 1879-16-9

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1879-16-9 | Benzene, 1-methoxy-4-(methylthio)-

CAS No: 1879-16-9 Catalog No: AG002GK9 MDL No:MFCD00010587

Product Description

Catalog Number:

AG002GK9

Chemical Name:

Benzene, 1-methoxy-4-(methylthio)-

CAS Number:

1879-16-9

Molecular Formula:

C8H10OS

Molecular Weight:

154.2294

MDL Number:

MFCD00010587

IUPAC Name:

1-methoxy-4-methylsulfanylbenzene

InChI:

InChI=1S/C8H10OS/c1-9-7-3-5-8(10-2)6-4-7/h3-6H,1-2H3

InChI Key:

DQNSKXYRRRCKGH-UHFFFAOYSA-N

SMILES:

COc1ccc(cc1)SC

NSC Number:

124839

Properties

Complexity:

87.3

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

154.045g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

154.227g/mol

Monoisotopic Mass:

154.045g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

34.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.7

Literature

Title	Journal
Sequence analysis and heterologous expression of a new cytochrome P450 monooxygenase from Rhodococcus sp. for asymmetric sulfoxidation.	Applied microbiology and biotechnology 20100101
Screening for the calstabin-ryanodine receptor complex stabilizers JTV-519 and S-107 in doping control analysis.	Drug testing and analysis 20090101
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 20041207
Tuning emissive states in electrogenerated chemiluminescence.	Journal of the American Chemical Society 20040818
Oxidation of thioanisole and p-methoxythioanisole by lignin peroxidase: kinetic evidence of a direct reaction between compound II and a radical cation.	The Biochemical journal 20030915