- InChI
- InChI=1S/C11H24/c1-6-10(4)8-11(5)7-9(2)3/h9-11H,6-8H2,1-5H3
- InChI Key
- XHNIFDXYGLPJLP-UHFFFAOYSA-N
- Formula
- C11H24
- SMILES
- CCC(C)CC(C)CC(C)C
- Molecular Weight1
- 156.31
- CAS
- 62016-37-9
- Other Names
-
- 2,4,6-Trimethyl-octane
- 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).
- ΔvapH : Enthalpy of vaporization at a given temperature (kJ/mol).
- 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).
- Inp : Non-polar retention indices.
- I : Polar retention indices.
- 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 |
|---|---|---|---|
| ΔfG° | 34.42 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -286.21 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 13.68 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 38.92 | kJ/mol | Joback Calculated Property |
| log10WS | -3.70 | Crippen Calculated Property | |
| logPoct/wat | 4.105 | Crippen Calculated Property | |
| McVol | 165.850 | ml/mol | McGowan Calculated Property |
| Pc | 1975.31 | kPa | Joback Calculated Property |
| Inp | [955.00; 955.00] |
|
|
| Inp | 955.00 | NIST | |
| Inp | 955.00 | NIST | |
| I | 1058.00 | NIST | |
| Tboil | 449.76 | K | Joback Calculated Property |
| Tc | 621.98 | K | Joback Calculated Property |
| Tfus | 168.73 | K | Joback Calculated Property |
| Vc | 0.633 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [360.14; 453.69] | J/mol×K | [449.76; 621.98] |
|
| Cp,gas | 360.14 | J/mol×K | 449.76 | Joback Calculated Property |
| Cp,gas | 377.38 | J/mol×K | 478.46 | Joback Calculated Property |
| Cp,gas | 393.94 | J/mol×K | 507.17 | Joback Calculated Property |
| Cp,gas | 409.83 | J/mol×K | 535.87 | Joback Calculated Property |
| Cp,gas | 425.08 | J/mol×K | 564.57 | Joback Calculated Property |
| Cp,gas | 439.69 | J/mol×K | 593.28 | Joback Calculated Property |
| Cp,gas | 453.69 | J/mol×K | 621.98 | Joback Calculated Property |
| η | [0.0001963; 0.0437057] | Pa×s | [168.73; 449.76] |
|
| η | 0.0437057 | Pa×s | 168.73 | Joback Calculated Property |
| η | 0.0066714 | Pa×s | 215.57 | Joback Calculated Property |
| η | 0.0019921 | Pa×s | 262.41 | Joback Calculated Property |
| η | 0.0008579 | Pa×s | 309.25 | Joback Calculated Property |
| η | 0.0004611 | Pa×s | 356.08 | Joback Calculated Property |
| η | 0.0002863 | Pa×s | 402.92 | Joback Calculated Property |
| η | 0.0001963 | Pa×s | 449.76 | Joback Calculated Property |
| ΔvapH | 44.90 | kJ/mol | 383.50 | NIST |
Similar Compounds
Find more compounds similar to Octane, 2,4,6-trimethyl-.
Sources
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