AG000FGS

114926-38-4 | L-Phenylalanine, 4-(trifluoromethyl)-

AG000FGS

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CAS Number	114926-38-4
Catalog Number	AG000FGS(AGN-PC-0NYLC7)
Chemical Name	L-Phenylalanine, 4-(trifluoromethyl)-
IUPAC Name	(2S)-2-amino-3-[4-(trifluoromethyl)phenyl]propanoic acid
InChI	InChI=1S/C10H10F3NO2/c11-10(12,13)7-3-1-6(2-4-7)5-8(14)9(15)16/h1-4,8H,5,14H2,(H,15,16)/t8-/m0/s1
InChI Key	CRFFPDBJLGAGQL-QMMMGPOBSA-N
MDL Number	MFCD00044946
Molecular Formula	C10H10F3NO2
Molecular Weight	233.1871
SMILES	N[C@H](C(=O)O)Cc1ccc(cc1)C(F)(F)F
Synonyms	4-(trifluoromethyl)phenylalanine, tfm-Phe, tri-fluoromethyl-phenylalanine, trifluoromethyl-phenylalanine, trifluoromethylphenylalanine, 4-(Trifluoromethyl)-L-phenylalanine, 114926-38-4, (S)-2-amino-3-(4-(trifluoromethyl)phenyl)propanoic acid, (2S)-2-amino-3-[4-(trifluoromethyl)phenyl]propanoic acid, 4-Trifluoromethyl-L-Phenylalanine, MFCD00044946, L-Phenylalanine, 4-(trifluoromethyl)-, L-4-TRIFLUOROMETHYLPHE, L-4-Trifluoromethylphenylalanine, 4-Trifluromethyl-L-phenylalanine hydrochloride, (S)-beta-(p-Trifluoromethylphenyl)alanine, (S)-2-Amino-3-[4-(trifluoromethyl)phenyl]propionic acid, 122839-50-3, 3832-75-5, AK-25307, 122839-56-9, AC1MC53G, p-trifluoromethylphenylalanine, SCHEMBL43862, 4-(trifluoromethyl)phenylalanine, CTK3J1686, ZINC2149429, ZX-AP006528, ANW-45504, CT-390, AKOS010397236, AKOS015854053, (S)-b-(p-trifluoromethylphenyl)alanine, AB02000, AC-5864, AM83498, CS-W014678, PC01528, RTR-002722, AC-12382, AJ-33632, AK-41279, AN-10514, BR-25307, DS-10718, SC-10939, AB0034871, AX8017632, DB-016876, RT-024085, ST2411046, TL8000443, TR-002722, FT-0649689, X9097, S-3869, 4-(Trifluoromethyl)-L-phenylalanine, >=99.0%, I01-5164, I01-8304, J-003160, I14-32679, I14-32681, (2S)-2-amino-3-[4-(trifluoromethyl)phenyl]propionic acid, (2S)-2-azanyl-3-[4-(trifluoromethyl)phenyl]propanoic acid, C10H10F3NO2, ACN-026204, CID2761501, 4-(Trifluoromethyl)-l-phenylalanine, 97% - 1G 1g, 2-amino-3-[4-(trifluoromethyl)phenyl]propanoic Acid, 114872-99-0, 790203-84-8, (2R)-2-amino-3-[4-(trifluoromethyl)phenyl]propanoic acid, 14091-16-8,

Complexity	247
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	233.066g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	233.19g/mol
Monoisotopic Mass	233.066g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	63.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.6

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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