- InChI
- InChI=1S/C11H24/c1-6-10(4)11(5)8-7-9(2)3/h9-11H,6-8H2,1-5H3
- InChI Key
- VHBZECSWMWWTMQ-UHFFFAOYSA-N
- Formula
- C11H24
- SMILES
- CCC(C)C(C)CCC(C)C
- Molecular Weight1
- 156.31
- CAS
- 62016-14-2
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.4216 | Relay (1.0) Calculated Property | |
| ΔfG° | 34.42 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -296.83 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 13.68 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 51.43 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.28 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.78 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.105 | Crippen Calculated Property | |
| McVol | 165.850 | ml/mol | McGowan Calculated Property |
| Pc | 1975.31 | kPa | Joback Calculated Property |
| Tboil | 447.76 | K | Relay (1.0) Calculated Property |
| Tc | 622.23 | K | Relay (1.0) Calculated Property |
| Tfus | 192.49 | K | Relay (1.0) Calculated Property |
| Vc | 0.609 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [360.26; 453.82] | J/mol×K | [449.96; 622.26] | 
|
| Cp,gas | 360.26 | J/mol×K | 449.96 | Joback Calculated Property |
| Cp,gas | 377.50 | J/mol×K | 478.68 | Joback Calculated Property |
| Cp,gas | 394.07 | J/mol×K | 507.39 | Joback Calculated Property |
| Cp,gas | 409.96 | J/mol×K | 536.11 | Joback Calculated Property |
| Cp,gas | 425.21 | J/mol×K | 564.82 | Joback Calculated Property |
| Cp,gas | 439.82 | J/mol×K | 593.54 | Joback Calculated Property |
| Cp,gas | 453.82 | J/mol×K | 622.26 | Joback Calculated Property |
| η | [0.0001960; 0.0437057] | Pa×s | [168.73; 449.96] |
|
| η | 0.0437057 | Pa×s | 168.73 | Joback Calculated Property |
| η | 0.0066644 | Pa×s | 215.60 | Joback Calculated Property |
| η | 0.0019893 | Pa×s | 262.47 | Joback Calculated Property |
| η | 0.0008566 | Pa×s | 309.35 | Joback Calculated Property |
| η | 0.0004604 | Pa×s | 356.22 | Joback Calculated Property |
| η | 0.0002859 | Pa×s | 403.09 | Joback Calculated Property |
| η | 0.0001960 | Pa×s | 449.96 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Octane, 2,5,6-trimethyl-.
Sources
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