Basic Information | Post buying leads | Suppliers |
Name |
(Phenylmethyl)(1, 1-biphenyl)-4-ol |
EINECS | 286-730-2 |
CAS No. | 85353-67-9 | Density | 1.119 g/cm3 |
PSA | 20.23000 | LogP | 4.65000 |
Solubility | N/A | Melting Point |
N/A |
Formula | C19H16O | Boiling Point | 410.6 °C at 760 mmHg |
Molecular Weight | 260.32974 | Flash Point | 195.2 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
3-Benzyl-4-phenylphenol;Einecs 286-730-2; |
The (Phenylmethyl)(1, 1-biphenyl)-4-ol, has the CAS registry number of 85353-67-9. Its EINECS registry number is 286-730-2. This chemical's molecular formula is C19H16O and molecular weight is 260.32974. What's more, its IUPAC name is 3-Benzyl-4-phenylphenol and its systematic name is 3-Benzylbiphenyl-4-ol.
Physical properties about (Phenylmethyl)(1, 1-biphenyl)-4-ol are: (1)ACD/LogP: 5.19; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.19; (4)ACD/LogD (pH 7.4): 5.19; (5)ACD/BCF (pH 5.5): 5169.39; (6)ACD/BCF (pH 7.4): 5160.65; (7)ACD/KOC (pH 5.5): 15836.87; (8)ACD/KOC (pH 7.4): 15810.12; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 9.23 Å2; (13)Index of Refraction: 1.623; (14)Molar Refractivity: 82.04 cm3; (15)Molar Volume: 232.5 cm3; (16)Polarizability: 32.52×10-24 cm3; (17)Surface Tension: 46.3 dyne/cm; (18)Density: 1.119 g/cm3; (19)Flash Point: 195.2 °C; (20)Enthalpy of Vaporization: 68.88 kJ/mol; (21)Boiling Point: 410.6 °C at 760 mmHg; (22)Vapour Pressure: 2.5E-07 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: Oc1ccc(cc1Cc2ccccc2)c3ccccc3
(2) InChI: InChI=1/C19H16O/c20-19-12-11-17(16-9-5-2-6-10-16)14-18(19)13-15-7-3-1-4-8-15/h1-12,14,20H,13H2
(3) InChIKey: YZCWXIRNXBSTTB-UHFFFAOYAA