AG000PBU

1196155-38-0 | 4-Pyridinecarbonitrile, 2-chloro-6-(trifluoromethyl)-

AG000PBU

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CAS Number	1196155-38-0
Catalog Number	AG000PBU(AGN-PC-09RR7A)
Chemical Name	4-Pyridinecarbonitrile, 2-chloro-6-(trifluoromethyl)-
IUPAC Name	2-chloro-6-(trifluoromethyl)pyridine-4-carbonitrile
InChI	InChI=1S/C7H2ClF3N2/c8-6-2-4(3-12)1-5(13-6)7(9,10)11/h1-2H
InChI Key	DKJFUZIDAHUIJV-UHFFFAOYSA-N
MDL Number	MFCD13190042
Molecular Formula	C7H2ClF3N2
Molecular Weight	206.5524
SMILES	ClC=1C=C(C#N)C=C(N1)C(F)(F)F
Synonyms	1196155-38-0, 2-chloro-6-(trifluoromethyl)isonicotinonitrile, 2-CHLORO-6-TRIFLUOROMETHYL-ISONICOTINONITRILE, 2-CHLORO-6-(TRIFLUOROMETHYL)PYRIDINE-4-CARBONITRILE, AK-67720, SCHEMBL1335200, CTK4B1408, DTXSID60695956, DKJFUZIDAHUIJV-UHFFFAOYSA-N, 3385AA, ZINC71863943, AKOS015995125, AB69639, ACN-045293, CM10663, FCH1381385, NE63662, PC49663, RP26268, DS-16698, 2-chloro-6-trifluoromethylisonicotinonitrile, AJ-118825, AX8208522, CS-0030393, FT-0746994, KS-00000543, 2-Chloro-6-(trifluoromethyl);isonicotinonitrile, J-508915, 4-Pyridinecarbonitrile, 2-chloro-6-(trifluoromethyl)-, C7H2ClF3N2, MFCD13190042, 2-chloro-6-(trifluoromethyl)-4-Pyridinecarbonitrile, 386704-06-9,

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
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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