- InChI
- InChI=1S/C15H26O2/c1-11(10-16)12-5-8-14(2)6-4-7-15(3,17)13(14)9-12/h12-13,16-17H,1,4-10H2,2-3H3/t12-,13?,14-,15+/m0/s1
- InChI Key
- RMARCXQAHOJNRB-AVOUXACISA-N
- Formula
- C15H26O2
- SMILES
- C=C(CO)C1CCC2(C)CCCC(C)(O)C2C1
- Molecular Weight1
- 238.37
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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.
- 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 |
|---|---|---|---|
| ω | 0.6866 | Relay (1.0) Calculated Property | |
| ΔfG° | -72.23 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -443.23 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 17.61 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 109.48 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.79 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.76 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.892 | Crippen Calculated Property | |
| McVol | 207.930 | ml/mol | McGowan Calculated Property |
| Pc | 2395.87 | kPa | Joback Calculated Property |
| Inp | 1909.00 | NIST | |
| Tboil | 600.02 | K | Relay (1.0) Calculated Property |
| Tc | 842.63 | K | Relay (1.0) Calculated Property |
| Tfus | 358.92 | K | Relay (1.0) Calculated Property |
| Vc | 0.708 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [662.50; 766.74] | J/mol×K | [745.22; 946.40] | 
|
| Cp,gas | 662.50 | J/mol×K | 745.22 | Joback Calculated Property |
| Cp,gas | 680.15 | J/mol×K | 778.75 | Joback Calculated Property |
| Cp,gas | 697.45 | J/mol×K | 812.28 | Joback Calculated Property |
| Cp,gas | 714.57 | J/mol×K | 845.81 | Joback Calculated Property |
| Cp,gas | 731.70 | J/mol×K | 879.34 | Joback Calculated Property |
| Cp,gas | 749.02 | J/mol×K | 912.87 | Joback Calculated Property |
| Cp,gas | 766.74 | J/mol×K | 946.40 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4-«beta»-H-Eudesmen-11(13)-ene-4,12-diol.
Sources
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