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3-Fluoro-2-methylbenzenesulfonyl chloride

3-Fluoro-2-methylbenzenesulfonyl chloride - CAS 875166-92-0

Catalog:	BB038511
Product Name:	3-Fluoro-2-methylbenzenesulfonyl chloride
CAS:	875166-92-0
Synonyms:	3-fluoro-2-methylbenzenesulfonyl chloride; 3-fluoro-2-methylbenzenesulfonyl chloride

Technical Data

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Patents

Computed Properties

IUPAC Name:	3-fluoro-2-methylbenzenesulfonyl chloride
Description:	3-Fluoro-2-methylbenzenesulfonyl chloride (CAS# 875166-92-0) is a useful research chemical.
Molecular Weight:	208.64
Molecular Formula:	C7H6ClFO2S
Canonical SMILES:	CC1=C(C=CC=C1S(=O)(=O)Cl)F
InChI:	InChI=1S/C7H6ClFO2S/c1-5-6(9)3-2-4-7(5)12(8,10)11/h2-4H,1H3
InChI Key:	WKJLXHQGXSWSCK-UHFFFAOYSA-N
Boiling Point:	265.3 °C at 760 mmHg
Density:	1.423 g/cm³
Appearance:	Yellow solid
MDL:	MFCD07782175
LogP:	3.14240

Publication Number	Title	Priority Date
WO-2021074108-A1	Process of preparing 1,1'-disulfandiylbis(4-fluoro-2-methyl-5-nitrobenzol)	20191016
WO-2021028512-A1	Arylsulfonamide derivatives as mglur4 negative allosteric modulators	20190815
EP-3712143-A1	Quinazolinone compound and application thereof	20171113
US-2020317660-A1	Quinazolinone Compound and Application Thereof	20171113
KR-20180101510-A	Fluorine atom-containing compounds and their use	20160114

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Related Functional Groups

Sulfur Compounds

[91125-43-8]
Sulfophenyl nonanoate sodium salt
[2006276-82-8]
[3-(N,N-Dimethylsulfamoyl)phenyl]methanesulfonyl Chloride
[6633-90-5]
1,4-Butanedithiol diacetate
[85-47-2]
1-Naphthalenesulfonic acid
[71996-48-0]
1-Methyl-2-[(phenylsulfonyl)methyl]benzene
[104496-91-5]
2-(Pyridin-2-ylthio)acetohydrazide

GHS Hazard Statement:	H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
Precautionary Statement:	P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501
Signal Word:	Danger

Complexity:	247
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	207.9761065
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	207.9761065
Rotatable Bond Count:	1
Topological Polar Surface Area:	42.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.4