AG0055XG

832735-61-2 | 5-Bromo-1-(difluoromethyl)pyridin-2(1H)-one

AG0055XG

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CAS Number	832735-61-2
Catalog Number	AG0055XG(AGN-PC-03Z2RX)
Chemical Name	5-Bromo-1-(difluoromethyl)pyridin-2(1H)-one
IUPAC Name	5-bromo-1-(difluoromethyl)pyridin-2-one
InChI	InChI=1S/C6H4BrF2NO/c7-4-1-2-5(11)10(3-4)6(8)9/h1-3,6H
InChI Key	KMAQQDDPRGOPRF-UHFFFAOYSA-N
MDL Number	MFCD12911848
Molecular Formula	C6H4BrF2NO
Molecular Weight	224.0029
SMILES	O=C1C=CC(Br)=CN1C(F)F
Synonyms	5-Bromo-1-(difluoromethyl)pyridin-2(1H)-one, 832735-61-2, 2(1H)-Pyridinone, 5-bromo-1-(difluoromethyl)-, SCHEMBL589562, AMPD00192, CTK3D3102, KS-00001BFJ, DTXSID00630745, KMAQQDDPRGOPRF-UHFFFAOYSA-N, 2850AC, ANW-64126, MFCD12911848, ZINC59581637, AKOS015152362, FP-0056, QC-4213, AK-50156, AM804384, DS-15349, 5-bromo-1-difluoromethyl-1h-pyridin-2-one, 5-Bromo-1-difluoronethyl-1H-pyridin-2-one, AJ-113528, TC-152871, 4CH-021653, CS-0038589, FT-0759407, ST24044361, A1-06357, I02-2622, 5-bromo-1-(difluoromethyl)-1,2-dihydropyridin-2-one, 1-(Difluoromethyl)-5-bromo-1,2-dihydropyridine-2-one, C6H4BrF2NO,

Complexity	237
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	222.944g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	224.005g/mol
Monoisotopic Mass	222.944g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	20.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

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

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