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Cyclohexane, octyl-

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Name

Cyclohexane, octyl-

EINECS 217-271-8
CAS No. 1795-15-9 Density 0.807 g/cm3
PSA 0.00000 LogP 5.31730
Solubility N/A Melting Point -19.69°C
Formula C14H28 Boiling Point 264.5 °C at 760 mmHg
Molecular Weight 196.376 Flash Point 105.4 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 1795-15-9 (N-OCTYLCYCLOHEXANE) Hazard Symbols N/A
Synonyms

Octyl-cyclohexan;

Article Data 18

Cyclohexane, octyl- Specification

The Cyclohexane, octyl-, with the CAS registry number of 1795-15-9, is also known as Octyl-cyclohexan. Its EINECS registry number is 217-271-8. This chemical's molecular formula is C14H28 and molecular weight is 196.37. What's more, its IUPAC name is Octylcyclohexane.

Physical properties about the Cyclohexane, octyl- are: (1)ACD/LogP: 7.60; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 7.6; (4)ACD/LogD (pH 7.4): 7.6; (5)ACD/BCF (pH 5.5): 349849.25; (6)ACD/BCF (pH 7.4): 349849.25; (7)ACD/KOC (pH 5.5): 323506.78; (8)ACD/KOC (pH 7.4): 323506.78; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 7; (12)Polar Surface Area: 0 Å2; (13)Index of Refraction: 1.445; (14)Molar Refractivity: 64.79 cm3; (15)Molar Volume: 243 cm3; (16)Surface Tension: 28.7 dyne/cm; (17)Density: 0.807 g/cm3; (18)Flash Point: 105.4 °C; (19)Enthalpy of Vaporization: 48.22 kJ/mol; (20)Boiling Point: 264.5 °C at 760 mmHg; (21)Vapour Pressure: 0.0158 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: C(CCC1CCCCC1)CCCCC
(2) InChI: InChI=1/C14H28/c1-2-3-4-5-6-8-11-14-12-9-7-10-13-14/h14H,2-13H2,1H3
(3) InChIKey: FBXWCEKQCVOOLT-UHFFFAOYAT 

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