AG0036FX

81226-68-8 | 5-Bromo-2-chlorobenzene-1-sulfonyl chloride

AG0036FX

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CAS Number	81226-68-8
Catalog Number	AG0036FX(AGN-PC-08XSYO)
Chemical Name	5-Bromo-2-chlorobenzene-1-sulfonyl chloride
IUPAC Name	5-bromo-2-chlorobenzenesulfonyl chloride
InChI	InChI=1S/C6H3BrCl2O2S/c7-4-1-2-5(8)6(3-4)12(9,10)11/h1-3H
InChI Key	QWVGJTXXYAIKIB-UHFFFAOYSA-N
MDL Number	MFCD12026193
Molecular Formula	C6H3BrCl2O2S
Molecular Weight	289.9618
SMILES	ClC1=C(C=C(Br)C=C1)S(Cl)(=O)=O
Synonyms	5-bromo-2-chlorobenzene-1-sulfonyl chloride, 81226-68-8, 5-Bromo-2-chlorobenzenesulfonyl chloride, Benzenesulfonyl chloride, 5-bromo-2-chloro-, AC1Q3HF2, SCHEMBL2244585, CTK8B9866, DTXSID40679092, QWVGJTXXYAIKIB-UHFFFAOYSA-N, KS-000011DR, ANW-63340, MFCD12026193, TD1370, AKOS012210039, ZINC100011137, AS06907, DS-2433, MP-0391, QC-4092, 5-Bromo-2-chloro-benzenesulfonyl chloride, AK-84580, SC-94883, AB0051574, TC-152085, 4CH-000253, ST24023911, Z5151, EN300-66915, 5-Bromo-2-chlorobenzenesulfonyl chloride, AldrichCPR, C6H3BrCl2O2S, ACN-055862,

Complexity	249
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	287.841g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	289.952g/mol
Monoisotopic Mass	287.841g/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	8
Hazard statements	H317-H319
Packing Group	Ⅲ
Precautionary statements	P280-P305+P351+P338
UN Code	UN 3261

Certificate of Analysis

Lot Number