- InChI
- InChI=1S/C15H26O/c1-11-6-5-7-12-8-9-13(14(2,3)16)10-15(11,12)4/h10-12,16H,5-9H2,1-4H3/t11-,12?,15+/m1/s1
- InChI Key
- XEXRDVPNNGVFNR-YOMIOTDVSA-N
- Formula
- C15H26O
- SMILES
- CC1CCCC2CCC(C(C)(C)O)=CC12C
- Molecular Weight1
- 222.37
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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).
- 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° | 21.67 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -351.74 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 14.76 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 64.38 | kJ/mol | Joback Calculated Property |
| log10WS | -4.39 | Crippen Calculated Property | |
| logPoct/wat | 3.920 | Crippen Calculated Property | |
| McVol | 202.060 | ml/mol | McGowan Calculated Property |
| Pc | 2155.30 | kPa | Joback Calculated Property |
| Inp | 1625.00 | NIST | |
| I | 2189.00 | NIST | |
| Tboil | 661.82 | K | Joback Calculated Property |
| Tc | 874.07 | K | Joback Calculated Property |
| Tfus | 376.79 | K | Joback Calculated Property |
| Vc | 0.749 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [598.13; 704.35] | J/mol×K | [661.82; 874.07] | 
|
| Cp,gas | 598.13 | J/mol×K | 661.82 | Joback Calculated Property |
| Cp,gas | 618.08 | J/mol×K | 697.19 | Joback Calculated Property |
| Cp,gas | 636.92 | J/mol×K | 732.57 | Joback Calculated Property |
| Cp,gas | 654.81 | J/mol×K | 767.94 | Joback Calculated Property |
| Cp,gas | 671.91 | J/mol×K | 803.32 | Joback Calculated Property |
| Cp,gas | 688.38 | J/mol×K | 838.69 | Joback Calculated Property |
| Cp,gas | 704.35 | J/mol×K | 874.07 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Eremophil-9-en-11-ol.
Sources
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