Cyanomethanesulfonyl Chloride - CAS 27869-04-1

Catalog:	BB019694
Product Name:	Cyanomethanesulfonyl Chloride
CAS:	27869-04-1
Synonyms:	cyanomethanesulfonyl chloride; cyanomethanesulfonyl chloride

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Computed Properties

IUPAC Name:	cyanomethanesulfonyl chloride
Description:	Cyanomethanesulfonyl Chloride (CAS# 27869-04-1) is a useful research chemical.
Molecular Weight:	139.56
Molecular Formula:	C2H2ClNO2S
Canonical SMILES:	C(C#N)S(=O)(=O)Cl
InChI:	InChI=1S/C2H2ClNO2S/c3-7(5,6)2-1-4/h2H2
InChI Key:	QSOXEHOYDPAXTG-UHFFFAOYSA-N
MDL:	MFCD11646184
LogP:	1.15938

Publication Number	Title	Priority Date
KR-20210074208-A	Atomic layer etching	20191210
US-2021175088-A1	Atomic layer etching	20191210
US-2021171500-A1	Triazole carbamate pyridyl sulfonamides as lpa receptor antagonists and uses thereof	20191115
WO-2021097039-A1	Triazole carbamate pyridyl sulfonamides as lpa receptor antagonists and uses thereof	20191115
CN-110724142-A	Amide or sulfonamide substituted hydrazine derivatives as JAK kinase inhibitors	20191029

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[64038-58-0]
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GHS Hazard Statement:	H319 (97.44%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement:	P264, P280, P305+P351+P338, and P337+P313
Signal Word:	Warning

Complexity:	180
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	138.9494772
Formal Charge:	0
Heavy Atom Count:	7
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	138.9494772
Rotatable Bond Count:	1
Topological Polar Surface Area:	66.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.6