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Name |
2,4-Dicyclopentylphenol |
EINECS | 258-266-0 |
CAS No. | 52938-91-7 | Density | 1.072g/cm3 |
PSA | 20.23000 | LogP | 4.70740 |
Solubility | N/A | Melting Point |
N/A |
Formula | C16H22O | Boiling Point | 318.1 °C at 760 mmHg |
Molecular Weight | 230.35 | Flash Point | 148.6 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
2,4-dicyclopentylphenol;Einecs 258-266-0 |
Article Data | 2 |
The 2,4-Dicyclopentylphenol, with CAS registry number 52938-91-7, has the systematic name of 2,4-dicyclopentylphenol. Besides this, it is also called phenol, 2,4-dicyclopentyl-. And the chemical formula of this chemical is C16H22O. What's more, its EINECS is 258-266-0.
Physical properties of 2,4-Dicyclopentylphenol: (1)ACD/LogP: 5.39; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.39; (4)ACD/LogD (pH 7.4): 5.39; (5)ACD/BCF (pH 5.5): 7386.99; (6)ACD/BCF (pH 7.4): 7383.28; (7)ACD/KOC (pH 5.5): 20447.44; (8)ACD/KOC (pH 7.4): 20437.18; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 9.23 Å2; (13)Index of Refraction: 1.571; (14)Molar Refractivity: 70.63 cm3; (15)Molar Volume: 214.7 cm3; (16)Polarizability: 28×10-24cm3; (17)Surface Tension: 44.5 dyne/cm; (18)Density: 1.072 g/cm3; (19)Flash Point: 148.6 °C; (20)Enthalpy of Vaporization: 58.19 kJ/mol; (21)Boiling Point: 318.1 °C at 760 mmHg; (22)Vapour Pressure: 0.000198 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Oc1ccc(cc1C2CCCC2)C3CCCC3
(2)InChI: InChI=1/C16H22O/c17-16-10-9-14(12-5-1-2-6-12)11-15(16)13-7-3-4-8-13/h9-13,17H,1-8H2
(3)InChIKey: IGXUCIAXEPFJAX-UHFFFAOYAH
(4)Std. InChI: InChI=1S/C16H22O/c17-16-10-9-14(12-5-1-2-6-12)11-15(16)13-7-3-4-8-13/h9-13,17H,1-8H2
(5)Std. InChIKey: IGXUCIAXEPFJAX-UHFFFAOYSA-N