AG003LSQ

82964-91-8 | 4-Methylsulfonylbenzenesulfonyl chloride

AG003LSQ

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CAS Number	82964-91-8
Catalog Number	AG003LSQ(AGN-PC-0KK6XY)
Chemical Name	4-Methylsulfonylbenzenesulfonyl chloride
IUPAC Name	4-methylsulfonylbenzenesulfonyl chloride
InChI	InChI=1S/C7H7ClO4S2/c1-13(9,10)6-2-4-7(5-3-6)14(8,11)12/h2-5H,1H3
InChI Key	TYJOQICPGZGYDT-UHFFFAOYSA-N
MDL Number	MFCD00216486
Molecular Formula	C7H7ClO4S2
Molecular Weight	254.7111
SMILES	O=S(C1=CC=C(S(=O)(C)=O)C=C1)(Cl)=O
Synonyms	82964-91-8, 4-(Methylsulfonyl)benzenesulfonyl chloride, 4-(Methylsulfonyl)benzene-1-sulfonyl chloride, 4-methylsulfonylbenzenesulfonyl Chloride, 4-(methylsulphonyl)benzenesulphonyl chloride, 4-methanesulfonylbenzene-1-sulfonyl chloride, MFCD00216486, 4-methylsulfonylbenzenesulfonylchloride, PubChem5614, ACMC-20amd2, AC1MC2RD, AC1Q4GIC, AC1Q4GID, SCHEMBL230747, CTK3E7819, DTXSID80370617, TYJOQICPGZGYDT-UHFFFAOYSA-N, 2820AC, SBB101495, ZINC95712943, AKOS000131947, MCULE-8519792411, NE11389, RTR-025890, 4-methanesulfonylbenzenesulfonyl chloride, chloro[4-(methylsulfonyl)phenyl]sulfone, 4-methylsulfonylbenzene-sulfonyl chloride, 4-methylsulphonylbenzenesulphonyl chloride, 4-(Chlorosulphonyl)phenyl methyl sulphone, 4-methanesulfonyl benzenesulfonyl chloride, 4-Methanesulfonyl-benzenesulfonyl chloride, PS-10871, 4-(methylsulfonyl)-benzenesulfonyl chloride, AB1006732, DB-030264, TR-025890, 4-(Methanesulfonyl)benzenenesulfonyl chloride, 4-(methyl-sulphonyl)benzenesulphonyl chloride, Benzenesulfonylchloride, 4-(methylsulfonyl)-, FT-0628863, 4-MethanesulfonYl-Benzene-1-Sulfonyl Chloride, EN300-27864, 4-(Methanesulfonyl)benzene-1-sulfonyl chloride, 4-(methylsulfonyl)-benzene-1-sulfonyl chloride, 4-(Methylsulfonyl)benzenesulfonyl chloride, 97%, A840479, J-200072, I01-13461, null, C7H7ClO4S2, CID2735182, 4-(Methylsulfonyl)benzene-1-sulfonylchloride, 4-Methylsulfonylbenzenesulfonyl chloride, 96% - 10G 10g,

Complexity	378
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	253.947g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	254.699g/mol
Monoisotopic Mass	253.947g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	85A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.5

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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