AG000JAR

1227515-14-1 | 2(1H)-Pyridinone, 5-iodo-6-(trifluoromethyl)-

AG000JAR

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CAS Number	1227515-14-1
Catalog Number	AG000JAR(AGN-PC-0WCTBH)
Chemical Name	2(1H)-Pyridinone, 5-iodo-6-(trifluoromethyl)-
IUPAC Name	5-iodo-6-(trifluoromethyl)-1H-pyridin-2-one
InChI	InChI=1S/C6H3F3INO/c7-6(8,9)5-3(10)1-2-4(12)11-5/h1-2H,(H,11,12)
InChI Key	ZJWMBPKEDRAUAA-UHFFFAOYSA-N
MDL Number	MFCD16611365
Molecular Formula	C6H3F3INO
Molecular Weight	288.9938
SMILES	OC1=NC(C(F)(F)F)=C(I)C=C1
Synonyms	5-Iodo-6-(trifluoromethyl)pyridin-2-ol, 1227515-14-1, 6-hydroxy-3-iodo-2-(trifluoromethyl)pyridine, KS-00000RZI, DTXSID20858626, MFCD16611365, ZINC95929522, DS-7686, FCH1344959, AK143496, SC-67106, AJ-135507, AX8282754, 5-Iodo-6-(trifluoromethyl)pyridin-2(1H)-one,

Complexity	279
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	288.921g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	288.996g/mol
Monoisotopic Mass	288.921g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	29.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.3

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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