- InChI
- InChI=1S/C15H22O2/c1-5-6-7-15(16)17-14-10-12(4)8-9-13(14)11(2)3/h8-11H,5-7H2,1-4H3
- InChI Key
- RIJOKQDIPZLLFF-UHFFFAOYSA-N
- Formula
- C15H22O2
- SMILES
- CCCCC(=O)Oc1cc(C)ccc1C(C)C
- Molecular Weight1
- 234.33
- 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° | -67.79 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -389.42 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 27.13 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 61.35 | kJ/mol | Joback Calculated Property |
| log10WS | -4.70 | Crippen Calculated Property | |
| logPoct/wat | 4.214 | Crippen Calculated Property | |
| McVol | 205.890 | ml/mol | McGowan Calculated Property |
| Pc | 1885.44 | kPa | Joback Calculated Property |
| I | [1996.00; 1996.00] |
|
|
| I | 1996.00 | NIST | |
| I | 1996.00 | NIST | |
| Tboil | 655.09 | K | Joback Calculated Property |
| Tc | 857.92 | K | Joback Calculated Property |
| Tfus | 367.43 | K | Joback Calculated Property |
| Vc | 0.785 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [546.23; 633.44] | J/mol×K | [655.09; 857.92] |
|
| Cp,gas | 546.23 | J/mol×K | 655.09 | Joback Calculated Property |
| Cp,gas | 562.99 | J/mol×K | 688.89 | Joback Calculated Property |
| Cp,gas | 578.84 | J/mol×K | 722.70 | Joback Calculated Property |
| Cp,gas | 593.79 | J/mol×K | 756.50 | Joback Calculated Property |
| Cp,gas | 607.86 | J/mol×K | 790.31 | Joback Calculated Property |
| Cp,gas | 621.07 | J/mol×K | 824.11 | Joback Calculated Property |
| Cp,gas | 633.44 | J/mol×K | 857.92 | Joback Calculated Property |
| η | [0.0001243; 0.0014573] | Pa×s | [367.43; 655.09] |
|
| η | 0.0014573 | Pa×s | 367.43 | Joback Calculated Property |
| η | 0.0007630 | Pa×s | 415.37 | Joback Calculated Property |
| η | 0.0004568 | Pa×s | 463.32 | Joback Calculated Property |
| η | 0.0003010 | Pa×s | 511.26 | Joback Calculated Property |
| η | 0.0002131 | Pa×s | 559.20 | Joback Calculated Property |
| η | 0.0001593 | Pa×s | 607.15 | Joback Calculated Property |
| η | 0.0001243 | Pa×s | 655.09 | Joback Calculated Property |
Similar Compounds
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Sources
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