- InChI
- InChI=1S/C16H26/c1-10(2)14-8-15(11(3)4)13(7)16(9-14)12(5)6/h8-12H,1-7H3
- InChI Key
- CHVOYGXBBWPDEU-UHFFFAOYSA-N
- Formula
- C16H26
- SMILES
- Cc1c(C(C)C)cc(C(C)C)cc1C(C)C
- Molecular Weight1
- 218.38
- CAS
- 6319-85-3
- 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).
- 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° | 160.04 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -187.29 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 19.50 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 54.31 | kJ/mol | Joback Calculated Property |
| log10WS | -5.50 | Crippen Calculated Property | |
| logPoct/wat | 5.365 | Crippen Calculated Property | |
| McVol | 212.540 | ml/mol | McGowan Calculated Property |
| Pc | 1674.16 | kPa | Joback Calculated Property |
| Tboil | 605.78 | K | Joback Calculated Property |
| Tc | 809.13 | K | Joback Calculated Property |
| Tfus | 289.06 | K | Joback Calculated Property |
| Vc | 0.805 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [546.98; 650.17] | J/mol×K | [605.78; 809.13] | 
|
| Cp,gas | 546.98 | J/mol×K | 605.78 | Joback Calculated Property |
| Cp,gas | 566.60 | J/mol×K | 639.67 | Joback Calculated Property |
| Cp,gas | 585.22 | J/mol×K | 673.56 | Joback Calculated Property |
| Cp,gas | 602.85 | J/mol×K | 707.45 | Joback Calculated Property |
| Cp,gas | 619.54 | J/mol×K | 741.34 | Joback Calculated Property |
| Cp,gas | 635.30 | J/mol×K | 775.23 | Joback Calculated Property |
| Cp,gas | 650.17 | J/mol×K | 809.13 | Joback Calculated Property |
| η | [0.0001167; 0.0030834] | Pa×s | [289.06; 605.78] |
|
| η | 0.0030834 | Pa×s | 289.06 | Joback Calculated Property |
| η | 0.0011724 | Pa×s | 341.85 | Joback Calculated Property |
| η | 0.0005774 | Pa×s | 394.63 | Joback Calculated Property |
| η | 0.0003361 | Pa×s | 447.42 | Joback Calculated Property |
| η | 0.0002193 | Pa×s | 500.21 | Joback Calculated Property |
| η | 0.0001553 | Pa×s | 552.99 | Joback Calculated Property |
| η | 0.0001167 | Pa×s | 605.78 | Joback Calculated Property |
Similar Compounds
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Sources
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