AG005J2S

72256-93-0 | 4-Bromo-3-methylbenzene-1-sulfonyl chloride

AG005J2S

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CAS Number	72256-93-0
Catalog Number	AG005J2S(AGN-PC-0KK8KB)
Chemical Name	4-Bromo-3-methylbenzene-1-sulfonyl chloride
IUPAC Name	4-bromo-3-methylbenzenesulfonyl chloride
InChI	InChI=1S/C7H6BrClO2S/c1-5-4-6(12(9,10)11)2-3-7(5)8/h2-4H,1H3
InChI Key	JRNDXUKMWFVEIC-UHFFFAOYSA-N
MDL Number	MFCD03094696
Molecular Formula	C7H6BrClO2S
Molecular Weight	269.5433
SMILES	CC1=C(Br)C=CC(=C1)S(Cl)(=O)=O
Synonyms	72256-93-0, 4-Bromo-3-methylbenzenesulfonyl chloride, 4-Bromo-3-methylbenzene-1-sulfonyl chloride, 4-bromo-3-methylbenzenesulphonyl chloride, 4-Bromo-3-methylbenzenesulphonylchloride, 4-bromo-3-methyl-benzenesulfonyl Chloride, MFCD03094696, 6-Bromo-m-toluene-3-sulfonyl Chloride, 4-Bromo-3-methylbenzenesulfonyl chloride, 97%, PubChem15805, AC1MC7EP, ACMC-1BHO4, SCHEMBL17985, CTK2H7043, JRNDXUKMWFVEIC-UHFFFAOYSA-, DTXSID70372100, JRNDXUKMWFVEIC-UHFFFAOYSA-N, KS-00000LH5, ANW-36180, BBL100675, SBB082162, STL554469, ZINC95707663, (4-bromo-3-methylphenyl)chlorosulfone, AKOS000199881, MCULE-8778362084, VZ28534, 4-bromo-3-methylbenzene sulfonyl chloride, 4-bromo-3-methylphenyl sulphonyl chloride, AK-48468, AN-37487, BC004040, DS-14681, SC-45846, AB0004389, Benzenesulfonylchloride, 4-bromo-3-methyl-, DB-006714, ST2405631, TC-020587, 4-bromanyl-3-methyl-benzenesulfonyl chloride, B2343, FT-0601185, V0401, B-5041, A837467, I01-9148, J-200065, InChI=1/C7H6BrClO2S/c1-5-4-6(12(9,10)11)2-3-7(5)8/h2-4H,1H3, C7H6BrClO2S, 6-Bromotoluene-3-sulfonyl chloride, 4-Bromo-3-methylbenzenesulfonylchloride, CID2737503, 4-Bromo-3-methylbenzenesulfonyl chloride, 97% 1g, 4-Bromo-3-methylbenzenesulfonyl chloride, 98% - 1G 1g,

Complexity	247
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	267.896g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	269.537g/mol
Monoisotopic Mass	267.896g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	42.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3

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

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