AG001DIJ

145915-29-3 | Benzenesulfonyl chloride, 4-broMo-2-Methoxy-

AG001DIJ

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CAS Number	145915-29-3
Catalog Number	AG001DIJ(AGN-PC-02100U)
Chemical Name	Benzenesulfonyl chloride, 4-broMo-2-Methoxy-
IUPAC Name	4-bromo-2-methoxybenzenesulfonyl chloride
InChI	InChI=1S/C7H6BrClO3S/c1-12-6-4-5(8)2-3-7(6)13(9,10)11/h2-4H,1H3
InChI Key	QPPCLNMOYHCXMS-UHFFFAOYSA-N
MDL Number	MFCD11847575
Molecular Formula	C7H6BrClO3S
Molecular Weight	285.5427
SMILES	S(=O)(=O)(Cl)c1c(OC)cc(cc1)Br
Synonyms	4-Bromo-2-methoxybenzene-1-sulfonyl chloride, 145915-29-3, 4-Bromo-2-methoxybenzenesulfonyl chloride, Benzenesulfonyl chloride, 4-bromo-2-methoxy-, SCHEMBL4018384, CTK8C1729, DTXSID60595947, QPPCLNMOYHCXMS-UHFFFAOYSA-N, 7218AA, ANW-67140, MFCD11847575, AKOS016006758, ZINC100025855, FCH1406583, AK-89930, AS-41367, SC-33665, 4-bromo-2-methoxy-benzenesulfonyl chloride, AB0047790, AX8238257, ST2405610, TC-155885, W1803, 4-Bromo-2-(methyloxy)benzenesulfonyl chloride, 4-Bromo-2-methoxybenzene-1-sulfonyl chloride, 96%, C7H6BrClO3S, C20H20O6, 7,8,9,9-Tetradehydroisolariciresinol, ACN-050188, 4-Bromo-2-methoxybenzene-1-sulfonylchloride, 357645-16-0,

Complexity	261
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	283.891g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	285.536g/mol
Monoisotopic Mass	283.891g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	51.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H314
Packing Group	Ⅲ
Precautionary statements	P280-P305+P351+P338-P310
UN Code	UN 1760

Certificate of Analysis

Lot Number