AG000WP9

127162-96-3 | Benzenemethanesulfonyl chloride, 3-(trifluoromethyl)-

AG000WP9

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CAS Number	127162-96-3
Catalog Number	AG000WP9(AGN-PC-0PIHDI)
Chemical Name	Benzenemethanesulfonyl chloride, 3-(trifluoromethyl)-
IUPAC Name	[3-(trifluoromethyl)phenyl]methanesulfonyl chloride
InChI	InChI=1S/C8H6ClF3O2S/c9-15(13,14)5-6-2-1-3-7(4-6)8(10,11)12/h1-4H,5H2
InChI Key	WIGCBGFBBRJTLS-UHFFFAOYSA-N
MDL Number	MFCD01631926
Molecular Formula	C8H6ClF3O2S
Molecular Weight	258.6452
SMILES	FC(C1=CC(CS(Cl)(=O)=O)=CC=C1)(F)F
Synonyms	127162-96-3, 3-Trifluoromethylbenzylsulfonyl chloride, [3-(trifluoromethyl)phenyl]methanesulfonyl Chloride, (3-(Trifluoromethyl)phenyl)methanesulfonyl chloride, 3-Trifluoromethylbenzylsulfonylchloride, {[3-(TRIFLUOROMETHYL)PHENYL]METHYL}SULFONYL CHLORIDE, 3-(trifluoromethyl)phenylmethanesulfonyl chloride, [[3-(trifluoromethyl)phenyl]methyl]sulfonyl chloride, benzenemethanesulfonyl chloride, 3-(trifluoromethyl)-, [[3-(TRIFLUOROMETHYL)PHENYL]METHYL]SULFONYLCHLORIDE, ([3-(trifluoromethyl)phenyl]methyl)sulfonyl chloride, ([3-(trifluoromethyl)phenyl]methyl)sulfonylchloride, AC1MDRKN, AC1Q4IWU, ACMC-209bc7, AC1Q4J7U, SCHEMBL68245, BZS-M01-0, CTK4B5510, DTXSID70383291, WIGCBGFBBRJTLS-UHFFFAOYSA-N, ANW-18965, AR2918, GEO-02380, MFCD01631926, SBB055017, STL302102, ZINC95749465, AKOS000132741, AB09397, MCULE-9357449638, AS-45479, BP-10266, 3-[(Chlorosulphonyl)methyl]benzotrifluoride, AB0086855, DB-041852, RT-021325, BB 0260843, FT-0605416, 3-trifluoromethylbenzylsulfonyl chloride, 97%, EN300-60503, B-7053, chloro{[3-(trifluoromethyl)phenyl]methyl}sulfone, 3-(TRIFLUOROMETHYL)BENZYLSULPHONYL CHLORIDE, 3-(trifluoromethyl)phenylmethane sulfonyl chloride, (3-Trifluoromethyl-phenyl)-methanesulfonyl chloride, [3-(Trifluoromethyl)phenyl]methylsulphonyl chloride, {[3-(trifluoromethyl)phenyl]methylsulfonyl chloride, 3-trifluoromethylbenzylsulfonyl chloride, AldrichCPR, Benzenemethanesulfonylchloride, 3-(trifluoromethyl)-, F9995-1296, (3 - Trifluoromethyl - phenyl) - methanesulfonyl chloride, [3-(trifluoromethyl)phenyl]methylsulphonyl chloride, 3-[(chlorosulphonyl)methyl]benzotrifluoride, 4-Trifluoromethylbenzylsulfonyl chloride, CID2794646, ([4-(trifluoromethyl)phenyl]methyl)sulfonylchloride, (4-Trifluoromethyl-phenyl)-methanesulfonyl chloride,

Complexity	307
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	257.973g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	258.639g/mol
Monoisotopic Mass	257.973g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	42.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H302-H314
Packing Group	Ⅲ
Precautionary statements	P280-P305+P351+P338-P310
UN Code	UN 3261

Certificate of Analysis

Lot Number