Benzenepropanoic acid, b-amino-2-(trifluoromethyl)- (299165-24-5)

The 3-Amino-3-(2-(trifluoromethyl)phenyl)propanoic acid with cas registry number of 299165-24-5, is also called Dl-3-amino-3-(2-trifluoromethyl-phenyl)-propionic acid ; 3-amino-3-(2-trifluoromethyl-phenyl)-propionic acid ; rarechem al bl 0044 . The 3-Amino-3-(2-(trifluoromethyl)phenyl)propanoic acid belongs to the following product categories : (1)pharmacetical; (2)B-Amino .

Physical properties of 3-Amino-3-(2-(trifluoromethyl)phenyl)propanoic acid : (1)ACD/LogP: 1.48; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.01; (4)ACD/LogD (pH 7.4): -1.03; (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: 29.54 Å²; (13)Index of Refraction: 1.501; (14)Molar Refractivity: 50.51 cm³; (15)Molar Volume: 171.3 cm³; (16)Polarizability: 20.02×10^-24cm³; (17)Surface Tension: 39.8 dyne/cm; (18)Enthalpy of Vaporization: 58.01 kJ/mol; (19)Vapour Pressure: 0.000289 mmHg at 25°C.

You can still convert the following datas into molecular structure: (1)SMILES:FC(F)(F)c1ccccc1C(N)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); (3)InChIKey:MXKROQQTKYAUJB-UHFFFAOYAW; (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); (5)Std. InChIKey:MXKROQQTKYAUJB-UHFFFAOYSA-N.