Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
3-Amino-3-(2-hydroxyphenyl)propionic acid |
EINECS | N/A |
CAS No. | 5678-46-6 | Density | 1.329 g/cm3 |
PSA | 83.55000 | LogP | 1.56700 |
Solubility | N/A | Melting Point |
N/A |
Formula | C9H11NO3 | Boiling Point | 372.4 °C at 760 mmHg |
Molecular Weight | 181.191 | Flash Point | 179 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
Hydrocinnamicacid, b-amino-o-hydroxy- (7CI,8CI); |
Article Data | 7 |
The 3-Amino-3-(2-hydroxyphenyl)propionic acid is an organic compound with the formula C9H11NO3. The systematic name of this chemical is 3-amino-3-(2-hydroxyphenyl)propanoic acid. With the CAS registry number 5678-46-6, it is also named as benzenepropanoic acid, β-amino-2-hydroxy-. The product's category is B-Amino.
Physical properties about 3-Amino-3-(2-hydroxyphenyl)propionic acid are: (1)CD/LogP: 0.18; (2)ACD/LogD (pH 5.5): -2.33; (3)ACD/LogD (pH 7.4): -2.33; (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: 4; (9)#H bond donors: 4; (10)#Freely Rotating Bonds: 5; (11)Polar Surface Area: 38.77 Å2; (12)Index of Refraction: 1.612; (13)Molar Refractivity: 47.41 cm3; (14)Molar Volume: 136.2 cm3; (15)Polarizability: 18.79×10-24cm3; (16)Surface Tension: 65.8 dyne/cm; (17)Density: 1.329 g/cm3; (18)Flash Point: 179 °C; (19)Enthalpy of Vaporization: 65.36 kJ/mol; (20)Boiling Point: 372.4 °C at 760 mmHg; (21)Vapour Pressure: 3.33E-06 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)CC(N)c1ccccc1O
(2)InChI: InChI=1/C9H11NO3/c10-7(5-9(12)13)6-3-1-2-4-8(6)11/h1-4,7,11H,5,10H2,(H,12,13)
(3)InChIKey: BMUFWTKVAWBABX-UHFFFAOYAS
(4)Std. InChI: InChI=1S/C9H11NO3/c10-7(5-9(12)13)6-3-1-2-4-8(6)11/h1-4,7,11H,5,10H2,(H,12,13)
(5)Std. InChIKey: BMUFWTKVAWBABX-UHFFFAOYSA-N