AG003F6Y

51586-24-4 | 2,2,2-trifluoro-1-phenylethanamine

AG003F6Y

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CAS Number	51586-24-4
Catalog Number	AG003F6Y(AGN-PC-0084XU)
Chemical Name	2,2,2-trifluoro-1-phenylethanamine
EC Number	257-299-8
IUPAC Name	2,2,2-trifluoro-1-phenylethanamine
InChI	InChI=1S/C8H8F3N/c9-8(10,11)7(12)6-4-2-1-3-5-6/h1-5,7H,12H2
InChI Key	DZCAUMADOBDJJH-UHFFFAOYSA-N
MDL Number	MFCD01166245
Molecular Formula	C8H8F3N
Molecular Weight	175.1510
SMILES	NC(C1=CC=CC=C1)C(F)(F)F
Synonyms	51586-24-4, 2,2,2-Trifluoro-1-phenylethylamine, 2,2,2-Trifluoro-1-phenylethanamine, 2,2,2-Trifluoro-1-phenyl-ethylamine, alpha-(Trifluoromethyl)benzylamine, 2,2,2-trifluoro-1-phenylethan-1-amine, DZCAUMADOBDJJH-UHFFFAOYSA-N, (R)-(-)-alpha-(Trifluoromethyl)benzylamine, 2,2,2-trifluor-1-phenylethanamin, AK-44313, EINECS 257-299-8, PubChem18735, AC1Q1HEA, AC1L3HA4, SCHEMBL40002, alpha-phenyl trifluoroethylamine, AC1Q506G, CTK4J4533, KS-000009HJ, EINECS 244-747-2, 7200AB, ANW-72189, MFCD01166245, AKOS000178342, AKOS016843432, MCULE-5532616486, TRA0046182, (2,2,2-trifluoro-1-phenylethyl)amine, 2,2,2-Trifluoro-1-phenylethanamine #, alpha-(Trifluoromethyl)benzenemethanamine, Benzenemethanamine, a-(trifluoromethyl)-, BS-13645, EN001091, SY007239, AB0061923, AB1000922, DB-071378, TC-160934, 2,2,2-tris(fluoranyl)-1-phenyl-ethanamine, 4CH-002074, FT-0691297, EN300-42369, Benzenemethanamine, .alpha.-(trifluoromethyl)-, K-9474, MFCD01166245 (97+%), A828672, S01-0818, null, C8H8F3N, (R)-2,2,2-Trifluoro-1-phenylethanamine, C8-H8-F3-N, CID89166, AR-1D0360, (S)-2,2,2-Trifluoro-1-phenylethanamine, ACN-054701, 22038-85-3, 62197-94-8, 6325-50-4,

Complexity	138
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	175.061g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	175.154g/mol
Monoisotopic Mass	175.061g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	26A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1.9

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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