AG003JGK

886499-99-6 | 3-FLUORO-5-(TRIFLUOROMETHYL)BENZENESULPHONYL CHLORIDE

AG003JGK

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CAS Number	886499-99-6
Catalog Number	AG003JGK(AGN-PC-0WAOEM)
Chemical Name	3-FLUORO-5-(TRIFLUOROMETHYL)BENZENESULPHONYL CHLORIDE
IUPAC Name	3-fluoro-5-(trifluoromethyl)benzenesulfonyl chloride
InChI	InChI=1S/C7H3ClF4O2S/c8-15(13,14)6-2-4(7(10,11)12)1-5(9)3-6/h1-3H
InChI Key	LANWEGQCPRKLAI-UHFFFAOYSA-N
MDL Number	MFCD06660226
Molecular Formula	C7H3ClF4O2S
Molecular Weight	262.6091
SMILES	O=S(C1=CC(C(F)(F)F)=CC(F)=C1)(Cl)=O
Synonyms	886499-99-6, 3-fluoro-5-(trifluoromethyl)benzene-1-sulfonyl chloride, 3-Fluoro-5-trifluoromethylphenylsulphonyl chloride, 3-Fluoro-5-(trifluoromethyl)benzenesulphonyl chloride, 3-FLUORO-5-(TRIFLUOROMETHYL)BENZENESULFONYL CHLORIDE, MFCD06660226, SCHEMBL732747, 3-Fluoro-5-(trifluoromethyl)benzenesulphonylchloride, CTK7B8028, DTXSID80590696, LANWEGQCPRKLAI-UHFFFAOYSA-N, JRD-1799, 4533AC, ANW-44059, CL8743, FC0921, SBB102593, AKOS015890662, ZINC100006930, AB26714, AS-46095, DB-011198, TC-132804, FT-0731574, ST24028522, X-1275, 3-fluoro-5-trifluoromethylphenylsulfonyl chloride, 3-Fluoro-5-trifluoromethylbenzenesulfonyl chloride, chloro[5-fluoro-3-(trifluoromethyl)phenyl]sulfone, 3-fluoro-5-trifluoromethyl-benzenesulfonyl chloride, I01-7127, 3-fluoro-5-(trifluoromethyl)-benzenesulfonyl chloride, 3-Fluoro-5-(trifluoromethyl)benzenesulfonyl chloride, AldrichCPR, C7H3ClF4O2S, A10645,

Complexity	321
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	261.948g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	262.603g/mol
Monoisotopic Mass	261.948g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	42.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H314-H318
Packing Group	Ⅱ
Precautionary statements	P260-P303+P361+P353-P305+P351+P338-P301+P330+P331-P405-P501
UN Code	UN 3265

Certificate of Analysis

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