3-TRIFLUOROMETHYL-L-PHENYLALANINE

The IUPAC name of 3-(Trifluoromethyl)-L-phenylalanine is (2S)-2-amino-3-[3-(trifluoromethyl)phenyl]propanoic acid. With the CAS registry number 14464-68-7, it is also named as L-Phenylalanine,3-(trifluoromethyl)-. The product's categories are Amino Acids; Phenylalanine Analogs and other Aromatic Alpha Amino Acids; A-amino. Besides, it is white solid, which should be stored at -15 °C. In addition, its molecular formula is C₁₀H₁₀F₃NO₂ and its molecular weight is 233.19.

The other characteristics of 3-(Trifluoromethyl)-L-phenylalanine can be summarized as: (1)ACD/LogP: 1.69; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.81; (4)ACD/LogD (pH 7.4): -0.82; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 3; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 37.3 Å²; (13)Index of Refraction: 1.502; (14)Molar Refractivity: 50.47 cm³; (15)Molar Volume: 170.9 cm³; (16)Polarizability: 20×10^-24cm³; (17)Surface Tension: 39.6 dyne/cm; (18)Density: 1.364 g/cm³; (19)Flash Point: 135.9 °C; (20)Melting Point: 216 °C; (21)Enthalpy of Vaporization: 57.16 kJ/mol; (22)Boiling Point: 301.2 °C at 760 mmHg; (23)Vapour Pressure: 0.000475 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following: it is irritating to eyes, respiratory system and skin. Please do not breathe dust. And you should avoid contact with skin and eyes.

People can use the following data to convert to the molecule structure.
(1)SMILES: FC(F)(F)c1cccc(c1)C[C@H](C([O-])=O)[NH3+]
(2)InChI: InChI=1/C10H10F3NO2/c11-10(12,13)7-3-1-2-6(4-7)5-8(14)9(15)16/h1-4,8H,5,14H2,(H,15,16)/t8-/m1/s1
(3)InChIKey: BURBNIPKSRJAIQ-MRVPVSSYBH
(4)Std. InChI: InChI=1S/C10H10F3NO2/c11-10(12,13)7-3-1-2-6(4-7)5-8(14)9(15)16/h1-4,8H,5,14H2,(H,15,16)/t8-/m1/s1
(5)Std. InChIKey: BURBNIPKSRJAIQ-MRVPVSSYSA-N