AG000GOV

1156542-25-4 | 2-Pyridinecarbonitrile, 6-chloro-4-(trifluoromethyl)-

AG000GOV

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CAS Number	1156542-25-4
Catalog Number	AG000GOV(AGN-PC-0WAKW4)
Chemical Name	2-Pyridinecarbonitrile, 6-chloro-4-(trifluoromethyl)-
IUPAC Name	6-chloro-4-(trifluoromethyl)pyridine-2-carbonitrile
InChI	InChI=1S/C7H2ClF3N2/c8-6-2-4(7(9,10)11)1-5(3-12)13-6/h1-2H
InChI Key	HQVYLNKDLDHDMB-UHFFFAOYSA-N
MDL Number	MFCD00106773
Molecular Formula	C7H2ClF3N2
Molecular Weight	206.5524
SMILES	N#CC1=NC(Cl)=CC(C(F)(F)F)=C1
Synonyms	6-Chloro-4-(trifluoromethyl)picolinonitrile, 1156542-25-4, AK141403, 2-chloro-6-cyano-4-trifluoromethylpyridine, SCHEMBL2335140, KS-00000RUK, DTXSID40732414, HQVYLNKDLDHDMB-UHFFFAOYSA-N, MFCD00106773, ZINC88190104, AKOS022173310, DS-7273, FCH1330145, BBV-40206252, AJ-128173, ST24045285, 6-chloro-4-(trifluoromethyl)pyridine-2-carbonitrile, 2-Pyridinecarbonitrile, 6-chloro-4-(trifluoromethyl)-,

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	2.7

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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