AG000MFY

1245913-20-5 | 3-Pyridinecarbonitrile, 6-chloro-2-(trifluoromethyl)-

AG000MFY

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CAS Number	1245913-20-5
Catalog Number	AG000MFY(AGN-PC-09RP3K)
Chemical Name	3-Pyridinecarbonitrile, 6-chloro-2-(trifluoromethyl)-
IUPAC Name	6-chloro-2-(trifluoromethyl)pyridine-3-carbonitrile
InChI	InChI=1S/C7H2ClF3N2/c8-5-2-1-4(3-12)6(13-5)7(9,10)11/h1-2H
InChI Key	YNOOOWSRQHMRAA-UHFFFAOYSA-N
MDL Number	MFCD08061141
Molecular Formula	C7H2ClF3N2
Molecular Weight	206.5524
SMILES	N#CC1=C(C(F)(F)F)N=C(Cl)C=C1
Synonyms	6-Chloro-2-(trifluoromethyl)nicotinonitrile, 1245913-20-5, AK156197, SCHEMBL19690342, KS-00000SEA, MFCD11848371, ZINC75898640, AKOS023117277, DS-8759, FCH1406729, SC-29351, AJ-122081, AX8290522, 6-chloro-2-(trifluoromethyl)pyridine-3-carbonitril, 3-Pyridinecarbonitrile, 6-chloro-2-(trifluoromethyl)-, 6-Chloro-2-(trifluoromethyl)nicotinonitrile, AldrichCPR,

Complexity	232
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	205.986g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	206.552g/mol
Monoisotopic Mass	205.986g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	36.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number