AG00FHFN

683813-55-0 | (4-(TRIFLUOROMETHOXY)PHENYL)METHANESULFONYL CHLORIDE

AG00FHFN

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CAS Number	683813-55-0
Catalog Number	AG00FHFN(AGN-PC-0TSBKU)
Chemical Name	(4-(TRIFLUOROMETHOXY)PHENYL)METHANESULFONYL CHLORIDE
IUPAC Name	[4-(trifluoromethoxy)phenyl]methanesulfonyl chloride
InChI	InChI=1S/C8H6ClF3O3S/c9-16(13,14)5-6-1-3-7(4-2-6)15-8(10,11)12/h1-4H,5H2
InChI Key	PMHRLICMFSITAR-UHFFFAOYSA-N
MDL Number	MFCD09811274
Molecular Formula	C8H6ClF3O3S
Molecular Weight	274.6446
SMILES	O=S(CC1=CC=C(OC(F)(F)F)C=C1)(Cl)=O
Synonyms	4-(Trifluoromethoxy)phenylmethanesulfonyl chloride, 683813-55-0, [4-(trifluoromethoxy)phenyl]methanesulfonyl chloride, 4-(Trifluoromethoxy)benzylsulfonyl chloride, (4-(TRIFLUOROMETHOXY)PHENYL)METHANESULFONYL CHLORIDE, AC1Q4KFD, SCHEMBL20499450, CTK7B7404, BBL101133, GEO-02374, MFCD09811274, STL554929, AKOS000164466, ZINC100043016, SC-36434, AK00789514, EN300-66299, X-4054, (4-(trifluoromethoxy)phenyl)methanesulfonyl chlori, [4-(Trifluoromethoxy)phenyl]methylsulphonyl chloride, 4-(Chlorosulphonyl)-alpha,alpha,alpha-trifluoroanisole, Benzenemethanesulfonyl chloride, 4-(trifluoromethoxy)-, 4-(Trifluoromethoxy)phenylmethanesulfonyl chloride, AldrichCPR,

Complexity	314
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	273.968g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	274.638g/mol
Monoisotopic Mass	273.968g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	51.8A^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-H318
Packing Group	Ⅲ
Precautionary statements	P303+P361+P353-P210-P501-P260-P301+P330+P331-P305+P351+P338
UN Code	UN 3261

Certificate of Analysis

Lot Number