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3-Amino-3-[3-(trifluoromethyl)phenyl]propanoic acid (143438-91-9)

Identification
Name:3-Amino-3-[3-(trifluoromethyl)phenyl]propanoic acid
Synonyms:RARECHEM AK HW 0018;3-[3-(TRIFLUOROMETHYL)PHENYL]-BETA-ALANINE;3-AMINO-3-[3-(TRIFLUOROMETHYL)PHENYL]PROPANOIC ACID;3-AMINO-3-(3-TRIFLUOROMETHYL-PHENYL)-PROPIONIC ACID;DL-3-AMINO-3-(3-TRIFLUOROMETHYL-PHENYL)-PROPIONIC ACID;DL-3-AMINO-3-(3-TRIFLUOROMETHYL-PHENYL)-PHENYLPROPIONIC ACID
CAS:143438-91-9
Molecular Formula: C10H10F3NO2
Molecular Weight: 233.19
InChI: InChI=1/C10H10F3NO2/c11-10(12,13)7-3-1-2-6(4-7)8(14)5-9(15)16/h1-4,8H,5,14H2,(H,15,16)
Molecular Structure: (C10H10F3NO2) RARECHEM AK HW 0018;3-[3-(TRIFLUOROMETHYL)PHENYL]-BETA-ALANINE;3-AMINO-3-[3-(TRIFLUOROMETHYL)PHENYL]...
Properties
Melting Point: 210-212°C
Flash Point: 132.3°C
Boiling Point: 295.2°Cat760mmHg
Density:1.361g/cm3
Refractive index:1.501
Specification:

The 3-Amino-3-[3-(trifluoromethyl)phenyl]propanoic acid with its cas register number is 143438-91-9. The Systematic name about this chemical is 3-amino-3-[3-(trifluoromethyl)phenyl]propanoic acid. It belongs to the B-Amino.

Physical properties about 3-Amino-3-[3-(trifluoromethyl)phenyl]propanoic acid are: (1)ACD/LogP: 1.48; (2)ACD/LogD (pH 5.5): -1.02; (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: 29.54Å2; (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: 56.49 kJ/mol; (18)Vapour Pressure: 0.0007 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: FC(F)(F)c1cccc(c1)C(N)CC(=O)O
(2)InChI: InChI=1/C10H10F3NO2/c11-10(12,13)7-3-1-2-6(4-7)8(14)5-9(15)16/h1-4,8H,5,14H2,(H,15,16)
(3)InChIKey: WZXBASRNQXYUIP-UHFFFAOYAS
(4)Std. InChI: InChI=1S/C10H10F3NO2/c11-10(12,13)7-3-1-2-6(4-7)8(14)5-9(15)16/h1-4,8H,5,14H2,(H,15,16)
(5)Std. InChIKey: WZXBASRNQXYUIP-UHFFFAOYSA-N

Flash Point: 132.3°C
Safety Data
Hazard Symbols Xi: Irritant