Basic Information | Post buying leads | Suppliers |
Name |
3-Amino-4-(2-naphthyl)butyric acid |
EINECS | N/A |
CAS No. | 544455-87-0 | Density | 1.219 |
PSA | 63.32000 | LogP | 2.88460 |
Solubility | N/A | Melting Point |
N/A |
Formula | C14H15 N O2 | Boiling Point | 430.042 °C at 760 mmHg |
Molecular Weight | 229.27 | Flash Point | 213.882 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
(RS)-3-Amino-4-(2-naphthyl)butanoicacid;(?à)-3-Amino-4-(2-naphthyl)butanoicacid;(?à)-3-Amino-4-(2-naphthyl)butyricacid;2-naphthalenebutanoic acid, beta-amino-; |
The 3-Amino-4-(2-naphthyl)butyric acid with cas registry number of 544455-87-0, is also called (RS)-3-Amino-4-(2-naphthyl)butanoicacid; 2-naphthalenebutanoic acid, beta-amino-.
Physical properties of 3-Amino-4-(2-naphthyl)butyric acid: (1)ACD/LogP: 2.16; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0; (4)ACD/LogD (pH 7.4): 0; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 2; (8)ACD/KOC (pH 7.4): 2; (9)#H bond acceptors: 3; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 63.32 Å2; (13)Index of Refraction: 1.643; (14)Molar Refractivity: 67.969 cm3; (15)Molar Volume: 188.06 cm3; (16)Polarizability: 26.945×10-24cm3; (17)Surface Tension: 56.452 dyne/cm; (18)Enthalpy of Vaporization: 72.253 kJ/mol; (19)Vapour Pressure: 0 mmHg at 25°C .
You can still convert the following datas into molecular structure: (1)SMILES:OC(=O)CC(N)Cc1ccc2ccccc2c1; (2)InChI:InChI=1/C14H15NO2/c15-13(9-14(16)17)8-10-5-6-11-3-1-2-4-12(11)7-10/h1-7,13H,8-9,15H2,(H,16,17); (3)InChIKey:WSVMIVFELRCSPA-UHFFFAOYAJ; (4)Std. InChI:InChI=1S/C14H15NO2/c15-13(9-14(16)17)8-10-5-6-11-3-1-2-4-12(11)7-10/h1-7,13H,8-9,15H2,(H,16,17); (5)Std. InChIKey:WSVMIVFELRCSPA-UHFFFAOYSA-N.