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Cyclohexanol,2-(2-ethylhexyl)-

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Name

Cyclohexanol,2-(2-ethylhexyl)-

EINECS N/A
CAS No. 77189-05-0 Density 0.883 g/cm3
PSA 20.23000 LogP 4.14400
Solubility N/A Melting Point N/A
Formula C14H28O Boiling Point 272.2 °C at 760 mmHg
Molecular Weight 212.3715 Flash Point 113.3 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 77189-05-0 (2-(B-ETHYLHEXYL)-1-CYCLOHEXANOL) Hazard Symbols N/A
Synonyms

NSC60588;2-(2-Ethylhexyl)cyclohexanol;

 

Cyclohexanol,2-(2-ethylhexyl)- Specification

The Cyclohexanol,2-(2-ethylhexyl)-, with the CAS registry number 77189-05-0, is also known as 2-(2-Ethylhexyl)cyclohexanol. This chemical's molecular formula is C14H28O and molecular weight is 212.3715. What's more, its IUPAC name is 2-(2-Ethylhexyl)cyclohexan-1-ol.

Physical properties about Cyclohexanol,2-(2-ethylhexyl)- are: (1) ACD/LogP: 5.37; (2) # of Rule of 5 Violations: 1; (3) ACD/LogD (pH 5.5): 5.37; (4) ACD/LogD (pH 7.4): 5.37; (5) #H bond acceptors: 1; (6) #H bond donors: 1; (7) #Freely Rotating Bonds: 7; (8) Polar Surface Area: 20.23 Å2; (9) Index of Refraction: 1.463; (10) Molar Refractivity: 66.34 cm3; (11) Molar Volume: 240.4 cm3; (12) Polarizability: 26.3×10-24 cm3; (13) Surface Tension: 30.9 dyne/cm; (14) Density: 0.883 g/cm3; (15) Flash Point: 113.3 °C; (16) Enthalpy of Vaporization: 59.26 kJ/mol; (17) Boiling Point: 272.2 °C at 760 mmHg; (18) Vapour Pressure: 0.000801 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: OC1CCCCC1CC(CC)CCCC
(2) InChI: InChI=1/C14H28O/c1-3-5-8-12(4-2)11-13-9-6-7-10-14(13)15/h12-15H,3-11H2,1-2H3/t12-,13-,14+/m0/s1
(3) InChIKey: NAPNXSKYWJFVIE-MELADBBJBQ

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