AG009D5U

13656-52-5 | 3-(Difluoromethoxy)benzenesulphonyl chloride

AG009D5U

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CAS Number	13656-52-5
Catalog Number	AG009D5U(AGN-PC-0KKVUS)
Chemical Name	3-(Difluoromethoxy)benzenesulphonyl chloride
IUPAC Name	4,5-dichloro-2-fluorobenzenesulfonyl chloride
InChI	InChI=1S/C6H2Cl3FO2S/c7-3-1-5(10)6(2-4(3)8)13(9,11)12/h1-2H
InChI Key	ASIHENVNFXQLOH-UHFFFAOYSA-N
MDL Number	MFCD03094453
Molecular Formula	C6H2Cl3FO2S
Molecular Weight	263.5013
SMILES	ClC1=CC(=C(C=C1Cl)S(=O)(=O)Cl)F
Synonyms	13656-52-5, 4,5-dichloro-2-fluorobenzenesulfonyl chloride, 4,5-Dichloro-2-fluorobenzenesulphonyl chloride, 4,5-Dichloro-2-fluorobenzene-1-sulfonyl chloride, AC1MCNSY, SCHEMBL1829297, CTK7B8130, DTXSID20378839, MFCD03094453, SBB102693, ZINC95682153, AKOS016016472, BP-13357, PS-10808, (4,5-dichloro-2-fluorophenyl)chlorosulfone, DB-063154, 4,5-Dichloro-2-fluorophenylsulfonyl chloride, FT-0765107, K-4387, 1-(Chlorosulphonyl)-4,5-dichloro-2-fluorobenzene, 4,5-dichloro-2-fluorobenzenesulphonyl chloride, AldrichCPR, CID2774013, 3-(Difluoromethoxy)benzenesulphonyl chloride, 4,5-dichloro-2-fluoro-benzenesulfonyl Chloride,

Complexity	276
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	261.883g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	263.488g/mol
Monoisotopic Mass	261.883g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	42.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H302-H315-H319-H332-H335
Packing Group	\N
Precautionary statements	P280-P305+P351+P338-P310
UN Code	\N

Certificate of Analysis

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