AG007VRS

1101120-80-2 | 5-Cyano-2-fluorobenzene-1-sulfonyl chloride

AG007VRS

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CAS Number	1101120-80-2
Catalog Number	AG007VRS(AGN-PC-0WABCK)
Chemical Name	5-Cyano-2-fluorobenzene-1-sulfonyl chloride
IUPAC Name	5-cyano-2-fluorobenzenesulfonyl chloride
InChI	InChI=1S/C7H3ClFNO2S/c8-13(11,12)7-3-5(4-10)1-2-6(7)9/h1-3H
InChI Key	XLPGJVFDGAPUIH-UHFFFAOYSA-N
MDL Number	MFCD18394026
Molecular Formula	C7H3ClFNO2S
Molecular Weight	219.6206
SMILES	O=S(C1=CC(C#N)=CC=C1F)(Cl)=O
Synonyms	5-Cyano-2-fluorobenzene-1-sulfonyl chloride, 1101120-80-2, AK-94407, 5-CYANO-2-FLUOROPHENYLSULFONYL CHLORIDE, SCHEMBL3071018, CTK8B6143, DTXSID10717334, KS-00000Q2O, 1928AA, ANW-52850, CL8746, FCH927593, GEO-04128, MFCD18394026, AKOS006335202, ZINC100014598, 5-cyano-2-fluorobenzenesulfonyl chloride, DS-17978, AB0061162, AX8231732, TC-141595, 4CH-011823, ST24024067, X-3272, C7H3ClFNO2S, 4-chloro-3-nitrobenzenesulfonohydrazide, 5-Cyano-2-fluorobenzene-1-sulfonylchloride, 6655-80-7,

Complexity	328
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	218.956g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	219.614g/mol
Monoisotopic Mass	218.956g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	66.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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