AG0014XZ

1214377-57-7 | 2-Pyridinecarbonitrile, 5-bromo-3-(trifluoromethyl)-

AG0014XZ

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CAS Number	1214377-57-7
Catalog Number	AG0014XZ(AGN-PC-0BL84X)
Chemical Name	2-Pyridinecarbonitrile, 5-bromo-3-(trifluoromethyl)-
IUPAC Name	5-bromo-3-(trifluoromethyl)pyridine-2-carbonitrile
InChI	InChI=1S/C7H2BrF3N2/c8-4-1-5(7(9,10)11)6(2-12)13-3-4/h1,3H
InChI Key	VOZKRLOGKCRQIZ-UHFFFAOYSA-N
MDL Number	MFCD13185358
Molecular Formula	C7H2BrF3N2
Molecular Weight	251.0034
SMILES	BrC1=CN=C(C(=C1)C(F)(F)F)C#N
Synonyms	1214377-57-7, 5-Bromo-2-cyano-3-(trifluoromethyl)pyridine, 5-BROMO-3-(TRIFLUOROMETHYL)-2-PYRIDINECARBONITRILE, 5-bromo-3-(trifluoromethyl)pyridine-2-carbonitrile, 5-bromo-3-(trifluoromethyl)picolinonitrile, AK-74156, SCHEMBL20129085, CTK8C3842, DTXSID00719241, CS-D1548, KS-00000IH3, ZX-AP009901, ANW-70653, MFCD13185358, ZINC72187477, AKOS015920216, FCH1380583, LF10541, PC19686, BR-74156, CJ-21644, DS-15667, AB0035202, AJ-119094, AX8168868, DB-061911, TC-159398, 4CH-009302, FT-0703812, ST24029366, X9491, S-6340, 2-Pyridinecarbonitrile, 5-bromo-3-(trifluoromethyl)-, C7H2BrF3N2, ACN-056522,

Complexity	232
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	249.935g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	251.006g/mol
Monoisotopic Mass	249.935g/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-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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