Input interpretation
octane | 1, 4-dimethylcyclohexane
Chemical names and formulas
| octane | 1, 4-dimethylcyclohexane formula | CH_3(CH_2)_6CH_3 | C_6H_10(CH_3)_2 Hill formula | C_8H_18 | C_8H_16 name | octane | 1, 4-dimethylcyclohexane IUPAC name | octane | 1, 4-dimethylcyclohexane alternate names | N-octane | oktan | oktanen | ottani | cyclohexane, 1, 4-dimethyl- | hexahydroxylene | p-dimethylcyclohexane mass fractions | C (carbon) 84.1% | H (hydrogen) 15.9% | C (carbon) 85.6% | H (hydrogen) 14.4%
Structure diagrams
| octane | 1, 4-dimethylcyclohexane vertex count | 8 | 8 edge count | 7 | 8 Schultz index | 306 | 272 Wiener index | 84 | 62 Hosoya index | 34 | 38 Balaban index | 2.53 | 2.192
3D structure
3D structure
Basic properties
| octane | 1, 4-dimethylcyclohexane molar mass | 114.23 g/mol | 112.22 g/mol phase | liquid (at STP) | liquid (at STP) melting point | -57 °C | -87 °C boiling point | 126 °C | 120 °C density | 0.703 g/cm^3 | 0.773 g/cm^3 solubility in water | insoluble | insoluble
Units
Hydrophobicity and permeability properties
| octane experimental LogP hydrophobicity | 5.18 predicted LogP hydrophobicity | 4.73 experimental LogS | -5.24 predicted LogS | -4.53
Liquid properties
| octane | 1, 4-dimethylcyclohexane density | 0.703 g/cm^3 | 0.773 g/cm^3 vapor pressure | 11 mmHg | 10 mmHg dynamic viscosity | 5.08×10^-4 Pa s | refractive index | 1.398 | 1.426
Units
