AG003H4A

69360-26-5 | 2-Cyanobenzene-1-sulfonyl chloride

AG003H4A

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CAS Number	69360-26-5
Catalog Number	AG003H4A(AGN-PC-0JSAJV)
Chemical Name	2-Cyanobenzene-1-sulfonyl chloride
IUPAC Name	2-cyanobenzenesulfonyl chloride
InChI	InChI=1S/C7H4ClNO2S/c8-12(10,11)7-4-2-1-3-6(7)5-9/h1-4H
InChI Key	NQAYCMBZPAARNO-UHFFFAOYSA-N
MDL Number	MFCD00052341
Molecular Formula	C7H4ClNO2S
Molecular Weight	201.6302
SMILES	O=S(C1=CC=CC=C1C#N)(Cl)=O
Synonyms	2-Cyanobenzenesulfonyl chloride, 69360-26-5, 2-cyanobenzene-1-sulfonyl chloride, 2-Cyanobenzenesulphonyl chloride, 2-Cyanobenzensulfonyl chloride, 2-cyanobenzenesulfonylchloride, 2-cyano-benzenesulfonyl chloride, NQAYCMBZPAARNO-UHFFFAOYSA-N, EN300-07943, 2-cyanophenylsulfonyl chloride, PubChem5107, AC1LAWSI, AC1Q3VM0, AC1Q3VM1, cyanobenzenesulfonyl chloride, 2-cyanobenzensulfonylchloride, ACMC-1B3M7, SCHEMBL489976, 2-cyanobenzene sulfonyl chloride, CTK2F2793, DTXSID70334925, Benzenesulfonylchloride, 2-cyano-, KS-000012NA, ZX-AT006482, 2-Cyanobenzenesulfonic acid chloride, 2-(chlorosulfonyl)benzenecarbonitrile, ANW-35647, BBL104388, KM1261, MFCD00052341, OR8940, SBB066485, STL558660, ZINC59796647, 2-Cyanobenzenesulfonyl chloride, 98%, AKOS001060118, FCH2255920, MCULE-5392236069, RP04329, VZ24459, AK-81742, AN-37924, AS-15464, BBV-33121982, CC-10345, P479, AB0001432, AB1003291, AX8004193, DB-020976, ST2404376, TL8004854, TR-023083, C1811, FT-0612107, 360C265, A836451, C-09653, I09-0710, J-509205, F2167-0072, null, C7H4ClNO2S, CID522347, ACN-050472, Benzenesulfonyl chloride, 2-cyano- (9CI), 2-Cyanobenzene-1-sulfonyl chloride, 97% - 1G 1g,

Complexity	297
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	200.965g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	201.624g/mol
Monoisotopic Mass	200.965g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	66.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H314
Packing Group	Ⅱ
Precautionary statements	P280-P305+P351+P338-P310
UN Code	UN 3261

Certificate of Analysis

Lot Number