4-(4-Ethylcyclohexyl)cyclohexanone supplier

Name
4-(4-Ethylcyclohexyl)cyclohexanone
EINECS
CAS No. 150763-13-6
Density 0.944 g/cm³
Solubility
Melting Point
Formula C₁₄H₂₄O
Boiling Point 299.395 °C at 760 mmHg
Molecular Weight 208.344
Flash Point 127.273 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms [4'-Ethyl-1,1'-bicyclohexyl]-4-one;
PSA 17.07000
LogP 3.96210

4-(4-Ethylcyclohexyl)cyclohexanone Specification

The [1,1'-Bicyclohexyl]-4-one,4'-ethyl has the CAS registry number 150763-13-6. This chemical's molecular formula is C₁₄H₂₄O and molecular weight is 208.34. What's more, its systematic name is 4'-ethyl-1,1'-bi(cyclohexyl)-4-one.

Physical properties of [1,1'-Bicyclohexyl]-4-one,4'-ethyl are: (1)ACD/LogP: 4.37; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4; (4)ACD/LogD (pH 7.4): 4; (5)ACD/BCF (pH 5.5): 1165; (6)ACD/BCF (pH 7.4): 1165; (7)ACD/KOC (pH 5.5): 5451; (8)ACD/KOC (pH 7.4): 5451; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 17.07 Å²; (13)Index of Refraction: 1.481; (14)Molar Refractivity: 62.842 cm³; (15)Molar Volume: 220.627 cm³; (16)Polarizability: 24.912×10^-24cm³; (17)Surface Tension: 33.513 dyne/cm; (18)Density: 0.944 g/cm³; (19)Flash Point: 127.273 °C; (20)Enthalpy of Vaporization: 53.939 kJ/mol; (21)Boiling Point: 299.395 °C at 760 mmHg; (22)Vapour Pressure: 0.001 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C1CCC(CC1)C2CCC(CC2)CC
(2)Std. InChI: InChI=1S/C14H24O/c1-2-11-3-5-12(6-4-11)13-7-9-14(15)10-8-13/h11-13H,2-10H2,1H3
(3)Std. InChIKey: ICCIOWLZPJIEBA-UHFFFAOYSA-N

Product Name

4-(4-Ethylcyclohexyl)cyclohexanone

4-(4-Ethylcyclohexyl)cyclohexanone Specification

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