Benzenepropanoic acid, b-amino-2-(trifluoromethyl)-, (bR)- (791582-16-6)

The CAS register number of (R)-3-Amino-3-(2-(trifluoromethyl)phenyl)propanoic acid is 791582-16-6. It also can be called as Benzenepropanoic acid, b-amino-2-(trifluoromethyl)-, (bR)- and the systematic name about this chemical is (3R)-3-ammonio-3-[2-(trifluoromethyl)phenyl]propanoate. The molecular formula about this chemical is C₁₀H₁₀F₃NO₂ and molecular weight is 233.19. It belongs to the following product categories, such as 3-Amino-3-phenylpropanoic Acid Analogs; Pharmacetical; B-Amino and so on.

Physical properties about (R)-3-Amino-3-(2-(trifluoromethyl)phenyl)propanoic acid are: (1)ACD/LogP: 1.48; (2)ACD/LogD (pH 5.5): -1.01; (3)ACD/LogD (pH 7.4): -1.03; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 3; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 4; (11)Polar Surface Area: 37.3Ų; (12)Index of Refraction: 1.501; (13)Molar Refractivity: 50.51 cm³; (14)Molar Volume: 171.3 cm³; (15)Polarizability: 20.02x10^-24cm³; (16)Surface Tension: 39.8 dyne/cm; (17)Enthalpy of Vaporization: 58.01 kJ/mol; (18)Boiling Point: 308.7 °C at 760 mmHg; (19)Vapour Pressure: 0.000289 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: FC(F)(F)c1ccccc1[C@H]([NH3+])CC([O-])=O
(2)InChI: InChI=1/C10H10F3NO2/c11-10(12,13)7-4-2-1-3-6(7)8(14)5-9(15)16/h1-4,8H,5,14H2,(H,15,16)/t8-/m1/s1
(3)InChIKey: MXKROQQTKYAUJB-MRVPVSSYBP
(4)Std. InChI: InChI=1S/C10H10F3NO2/c11-10(12,13)7-4-2-1-3-6(7)8(14)5-9(15)16/h1-4,8H,5,14H2,(H,15,16)/t8-/m1/s1
(5)Std. InChIKey: MXKROQQTKYAUJB-MRVPVSSYSA-N