- InChI
- InChI=1S/C12H18/c1-8(2)12-7-6-9(3)10(4)11(12)5/h6-8H,1-5H3
- InChI Key
- QHOPYXBAXVDHDW-UHFFFAOYSA-N
- Formula
- C12H18
- SMILES
- Cc1ccc(C(C)C)c(C)c1C
- Molecular Weight1
- 162.27
- 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).
- 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).
- 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° | 131.24 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -94.17 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 16.19 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 46.18 | kJ/mol | Joback Calculated Property |
| log10WS | -4.08 | Crippen Calculated Property | |
| logPoct/wat | 3.735 | Crippen Calculated Property | |
| McVol | 156.180 | ml/mol | McGowan Calculated Property |
| Pc | 2320.31 | kPa | Joback Calculated Property |
| I | [1536.00; 1536.00] |
|
|
| I | 1536.00 | NIST | |
| I | 1536.00 | NIST | |
| I | 1536.00 | NIST | |
| I | 1536.00 | NIST | |
| Tboil | 515.14 | K | Joback Calculated Property |
| Tc | 722.37 | K | Joback Calculated Property |
| Tfus | 273.98 | K | Joback Calculated Property |
| Vc | 0.594 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [347.52; 433.58] | J/mol×K | [515.14; 722.37] |
|
| Cp,gas | 347.52 | J/mol×K | 515.14 | Joback Calculated Property |
| Cp,gas | 363.75 | J/mol×K | 549.68 | Joback Calculated Property |
| Cp,gas | 379.20 | J/mol×K | 584.22 | Joback Calculated Property |
| Cp,gas | 393.88 | J/mol×K | 618.76 | Joback Calculated Property |
| Cp,gas | 407.83 | J/mol×K | 653.30 | Joback Calculated Property |
| Cp,gas | 421.05 | J/mol×K | 687.83 | Joback Calculated Property |
| Cp,gas | 433.58 | J/mol×K | 722.37 | Joback Calculated Property |
| η | [0.0001767; 0.0017985] | Pa×s | [273.98; 515.14] |
|
| η | 0.0017985 | Pa×s | 273.98 | Joback Calculated Property |
| η | 0.0009540 | Pa×s | 314.17 | Joback Calculated Property |
| η | 0.0005843 | Pa×s | 354.37 | Joback Calculated Property |
| η | 0.0003955 | Pa×s | 394.56 | Joback Calculated Property |
| η | 0.0002877 | Pa×s | 434.75 | Joback Calculated Property |
| η | 0.0002209 | Pa×s | 474.95 | Joback Calculated Property |
| η | 0.0001767 | Pa×s | 515.14 | Joback Calculated Property |
Similar Compounds
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Sources
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