AG003I68

387350-39-2 | 3-​Pyridinemethanamine, 6-​(trifluoromethyl)​-

AG003I68

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CAS Number	387350-39-2
Catalog Number	AG003I68(AGN-PC-0KK8PS)
Chemical Name	3-​Pyridinemethanamine, 6-​(trifluoromethyl)​-
IUPAC Name	[6-(trifluoromethyl)pyridin-3-yl]methanamine
InChI	InChI=1S/C7H7F3N2/c8-7(9,10)6-2-1-5(3-11)4-12-6/h1-2,4H,3,11H2
InChI Key	XPXVAYGVYBQKDE-UHFFFAOYSA-N
MDL Number	MFCD01862649
Molecular Formula	C7H7F3N2
Molecular Weight	176.1391
SMILES	C(F)(F)(F)c1ccc(cn1)CN
Synonyms	387350-39-2, 3-(aminomethyl)-6-(trifluoromethyl)pyridine, 3-Aminomethyl-6-(trifluoromethyl)pyridine, (6-(trifluoromethyl)pyridin-3-yl)methanamine, [6-(trifluoromethyl)pyridin-3-yl]methanamine, 5-(aminomethyl)-2-(trifluoromethyl)pyridine, 5-aminomethyl-2-(trifluoromethyl)pyridine, 3-Pyridinemethanamine, 6-(trifluoromethyl)-, [6-(trifluoromethyl)pyridin-3-yl]methylamine, [6-(trifluoromethyl)-3-pyridyl]methylamine, PubChem7677, AC1MC7QJ, SCHEMBL40545, CTK4I0387, DTXSID10372225, XPXVAYGVYBQKDE-UHFFFAOYSA-N, ZINC154410, KS-00000K3J, ANW-56222, MFCD01862649, SBB052456, AKOS006230000, 3-aminomethyl-6-trifluoromethylpyridine, AB10256, AN-3903, CA-1780, CS-W006446, FS-1196, MCULE-9483274165, QC-3065, RP02963, RTR-015599, TRA0071231, VP10514, 3-aminomethyl-6-trifluoromethyl pyridine, 5-aminomethyl-2-trifluoromethyl pyridine, AJ-13212, AK-29992, SC-04060, SY009409, [6-(trifluoromethyl)-3-pyridyl]methanamine, 3-Pyridinemethanamine,6-(trifluoromethyl)-, AB0062607, DB-069715, FT-0647096, ST24041519, ST50949534, Y8955, [6-(trifluoromethyl)-3-pyridinyl]methanamine, C-(6-trifluoromethyl-pyridin-3-yl)-methylamine, K-8420, ([6-(trifluoromethyl)pyridin-3-yl]methyl)amine, 1-[6-(trifluoromethyl)pyridin-3-yl]methanamine, MFCD01862649 (95+%), 350A392, 6-(TRIFLUOROMETHYL)-3-PYRIDINEMETHANAMINE, A824249, I02-1382, J-501641, 3-Aminomethyl-6-(trifluoromethyl)pyridine, AldrichCPR, C7H7F3N2, ACN-034668, CID2737718, 388565-75-1,

Complexity	146
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	176.056g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	176.142g/mol
Monoisotopic Mass	176.056g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	38.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P305+P351+P338
UN Code	UN 2811

Certificate of Analysis

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