AG0039NO

573762-62-6 | 5-Amino-3-(trifluoromethyl)picolinonitrile

AG0039NO

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CAS Number	573762-62-6
Catalog Number	AG0039NO(AGN-PC-00MXYP)
Chemical Name	5-Amino-3-(trifluoromethyl)picolinonitrile
IUPAC Name	5-amino-3-(trifluoromethyl)pyridine-2-carbonitrile
InChI	InChI=1S/C7H4F3N3/c8-7(9,10)5-1-4(12)3-13-6(5)2-11/h1,3H,12H2
InChI Key	WLMSCOVORZUSNW-UHFFFAOYSA-N
MDL Number	MFCD17010171
Molecular Formula	C7H4F3N3
Molecular Weight	187.1220
SMILES	N#CC1=NC=C(N)C=C1C(F)(F)F
Synonyms	5-amino-3-(trifluoromethyl)picolinonitrile, 573762-62-6, 5-AMINO-3-(TRIFLUOROMETHYL)PYRIDINE-2-CARBONITRILE, AK144322, 5-Amino-3-(trifluromethyl) picolinonitrile, SCHEMBL909269, DTXSID90543138, WLMSCOVORZUSNW-UHFFFAOYSA-N, BCP10064, KS-00000S0G, MFCD17010171, ZINC34080370, AKOS022186033, ACN-036192, CS-W019785, DS-7863, FCH1174570, MB69401, PC53326, QC-4621, MFCD17010171 (), AJ-86839, SC-43674, SY076270, 5-Amino-2-cyano-3-trifluoromethylpyridine, AX8272149, 2-cyano-3-(trifluoromethyl)-5-aminopyridine, 2-cyano-3-trifluoromethyl-5-(amino)pyridine, FT-0699827, ST24044325, 5-Amino-3-(trifluoromethyl)-2-pyridinecarbonitrile, 5-Amino-3-trifluoromethyl-pyridine-2-carbonitrile - 5G 5g,

Complexity	229
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	187.036g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	187.125g/mol
Monoisotopic Mass	187.036g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	62.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H302-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P305+P351+P338
UN Code	UN 3439

Certificate of Analysis

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