Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
3-Hydroxy-2,3-diphenylpropanoic acid |
EINECS | 226-673-2 |
CAS No. | 5449-26-3 | Density | 1.254 g/cm3 |
PSA | 57.53000 | LogP | 2.58840 |
Solubility | N/A | Melting Point |
N/A |
Formula | C15H14O3 | Boiling Point | 384.8 °C at 760 mmHg |
Molecular Weight | 242.274 | Flash Point | 200.7 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
Hydracrylicacid, 2,3-diphenyl- (6CI,7CI,8CI);2,3-Diphenyl-3-hydroxypropionic acid;NSC 44872; |
Article Data | 17 |
The Benzenepropanoic acid, β-hydroxy-α-phenyl- is an organic compound with the formula C15H14O3. The IUPAC name of this chemical is 3-Hydroxy-2,3-diphenylpropanoic acid. With the CAS registry number 5449-26-3, it is also named as 2,3-Diphenyl-3-hydroxypropanoic acid. Besides, its molecular weight is 242.27.
The physical properties of Benzenepropanoic acid, β-hydroxy-α-phenyl- are: (1)ACD/LogP: 2.15; (2)ACD/LogD (pH 5.5): 0.35; (3)ACD/LogD (pH 7.4): -1.28; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 5.56; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 5; (11)Polar Surface Area: 35.53 Å2; (12)Index of Refraction: 1.622; (13)Molar Refractivity: 68.02 cm3; (14)Molar Volume: 193 cm3; (15)Polarizability: 26.96×10-24 cm3; (16)Surface Tension: 57.4 dyne/cm; (17)Density: 1.254 g/cm3; (18)Flash Point: 200.7 °C; (19)Enthalpy of Vaporization: 66.83 kJ/mol; (20)Boiling Point: 384.8 °C at 760 mmHg; (21)Vapour Pressure: 1.31E-06 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)C(c1ccccc1)C(O)c2ccccc2
(2)InChI: InChI=1/C15H14O3/c16-14(12-9-5-2-6-10-12)13(15(17)18)11-7-3-1-4-8-11/h1-10,13-14,16H,(H,17,18)
(3)InChIKey: SHLDFCNQGMQVSJ-UHFFFAOYAS
(4)Std. InChI: InChI=1S/C15H14O3/c16-14(12-9-5-2-6-10-12)13(15(17)18)11-7-3-1-4-8-11/h1-10,13-14,16H,(H,17,18)
(5)Std. InChIKey: SHLDFCNQGMQVSJ-UHFFFAOYSA-N