AG003BZV

802919-90-0 | ((Difluoroiodomethyl)sulfonyl)benzene

AG003BZV

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CAS Number	802919-90-0
Catalog Number	AG003BZV(AGN-PC-0NHYXZ)
Chemical Name	((Difluoroiodomethyl)sulfonyl)benzene
IUPAC Name	[difluoro(iodo)methyl]sulfonylbenzene
InChI	InChI=1S/C7H5F2IO2S/c8-7(9,10)13(11,12)6-4-2-1-3-5-6/h1-5H
InChI Key	LIPDDCLPIKKOTB-UHFFFAOYSA-N
MDL Number	MFCD28100936
Molecular Formula	C7H5F2IO2S
Molecular Weight	318.0797
SMILES	O=S(C1=CC=CC=C1)(C(F)(F)I)=O
Synonyms	802919-90-0, ((Difluoroiodomethyl)sulfonyl)benzene, Benzene, [(difluoroiodomethyl)sulfonyl]-, (difluoroiodomethylsulfonyl)benzene, [difluoro(iodo)methyl]sulfonylbenzene, AK198815, SCHEMBL2853702, iododifluoromethyl phenyl sulfone, CTK2I7564, DTXSID30478834, Phenyl(difluoroiodomethyl) sulfone, MFCD28100936, ZINC38879901, AKOS026674021, CS-W000699, FCH2572552, KS-000001H5, Difluoroiodomethyl phenyl sulfone, 98% - 1G 1g,

Complexity	265
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	317.902g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	318.076g/mol
Monoisotopic Mass	317.902g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	42.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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