AG0036XW

624734-22-1 | 2-Chloro-5-trifluoromethyl-nicotinonitrile

AG0036XW

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CAS Number	624734-22-1
Catalog Number	AG0036XW(AGN-PC-02M10Q)
Chemical Name	2-Chloro-5-trifluoromethyl-nicotinonitrile
IUPAC Name	2-chloro-5-(trifluoromethyl)pyridine-3-carbonitrile
InChI	InChI=1S/C7H2ClF3N2/c8-6-4(2-12)1-5(3-13-6)7(9,10)11/h1,3H
InChI Key	BWFBFKPZLKQYPR-UHFFFAOYSA-N
MDL Number	MFCD10697685
Molecular Formula	C7H2ClF3N2
Molecular Weight	206.5524
SMILES	N#Cc1cc(cnc1Cl)C(F)(F)F
Synonyms	2-Chloro-5-(trifluoromethyl)nicotinonitrile, 624734-22-1, 2-CHLORO-5-TRIFLUOROMETHYL-NICOTINONITRILE, AK-80091, 3-Pyridinecarbonitrile, 2-chloro-5-(trifluoromethyl)-, 2-CHLORO-5-(TRIFLUOROMETHYL)PYRIDINE-3-CARBONITRILE, SCHEMBL2634852, CTK2F2297, DTXSID00602129, BWFBFKPZLKQYPR-UHFFFAOYSA-N, ANW-58560, MFCD10697685, ZINC62720814, AKOS016003460, AB60237, FCH1401017, QC-3730, AC-29085, DS-15859, SC-29860, 2-Chloro-3-cyano-5-trifluoromethylpyridine, 2-chloro-3-cyano-5trifluoromethyl-pyridine, AB0080837, AJ-114239, AX8073295, DB-073125, TC-147305, FT-0709443, ST24040359, C-2168, 2-CHLORO-3-CYANO-5-(TRIFLUOROMETHYL)PYRIDINE, 2-CHLORO-5-(TRIFLUOROMETHYL)-3-PYRIDINECARBONITRILE, 2-chloro-5-(trifluoromethyl)pyridine-3-carbonitrile, 95% - 1G 1g,

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	2.4

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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