AG0011YL

13652-09-0 | Benzenemethanamine, α-(trifluoromethyl)-, hydrochloride (1:1)

AG0011YL

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CAS Number	13652-09-0
Catalog Number	AG0011YL(AGN-PC-068B4Y)
Chemical Name	Benzenemethanamine, α-(trifluoromethyl)-, hydrochloride (1:1)
IUPAC Name	2,2,2-trifluoro-1-phenylethanamine;hydrochloride
InChI	InChI=1S/C8H8F3N.ClH/c9-8(10,11)7(12)6-4-2-1-3-5-6;/h1-5,7H,12H2;1H
InChI Key	LCQGOISHUDYBOS-UHFFFAOYSA-N
MDL Number	MFCD00971700
Molecular Formula	C8H9ClF3N
Molecular Weight	211.6120
SMILES	Cl.NC(C1=CC=CC=C1)C(F)(F)F
Synonyms	13652-09-0, 2,2,2-Trifluoro-1-phenylethanamine hydrochloride, 2,2,2-Trifluoro-1-phenyl-ethylamine hydrochloride, 2,2,2-Trifluoro-1-phenylethylamine Hydrochloride, 2,2,2-trifluoro-1-phenylethan-1-amine hydrochloride, 2,2,2-TRIFLUORO-1-PHENYL-ETHYLAMINE HCL, (2,2,2-trifluoro-1-phenylethyl)amine hydrochloride, PubChem13913, AC1Q3CTU, SCHEMBL4708717, CTK8B6993, DTXSID90504688, KS-000009GL, ANW-55717, MFCD00971700, SBB094537, AKOS005255723, AB07860, MCULE-9032755128, RP04793, TRA0021660, 2,2,2-Trifluoro-1-phenylethylamine HCl, AC-29539, SY005422, AB0000106, DB-042345, ST2403556, TR-004887, 4CH-018853, 4CH-019228, CS-0089740, FT-0636933, Y7467, 2,2,2-trifluoro-1-phenylethylamine, chloride, EN300-65380, W-3755, 2,2,2-Trifluoro-1-phenylethylamineHydrochloride, MFCD00971700 (97+%), W-205484, I01-10455, Z1262398374, 2,2,2-Trifluoro-1-phenyl-ethylamine hydrochloride, AldrichCPR, Benzenemethanamine, a-(trifluoromethyl)-,hydrochloride (1:1), 2,2,2-Trifluoro-1-phenylethan-1-amine--hydrogen chloride (1/1), Benzenemethanamine, alpha-(trifluoromethyl)-, hydrochloride (1:1), C8H9ClF3N, ACN-054700, (R)-2,2,2-Trifluoro-1-phenylethanamine hydrochloride, (S)-2,2,2-Trifluoro-1-phenylethanamine hydrochloride, 189350-64-9, 128404-37-5,

Complexity	138
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	211.038g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	211.612g/mol
Monoisotopic Mass	211.038g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	26A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H319
Packing Group
Precautionary statements	P305+P351+P338
UN Code

Certificate of Analysis

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