- InChI
- InChI=1S/C15H24O/c1-6-12(2)8-7-9-13(3)10-11-14-15(4,5)16-14/h6,9,14H,1-2,7-8,10-11H2,3-5H3/b13-9+
- InChI Key
- VLCSIBCFYWQTOS-UKTHLTGXSA-N
- Formula
- C15H24O
- SMILES
- C=CC(=C)CCC=C(C)CCC1OC1(C)C
- Molecular Weight1
- 220.35
- 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.
- 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 |
|---|---|---|---|
| ω | 0.4831 | Relay (... Calculated Property | |
| ΔfG° | 275.65 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -164.04 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 30.51 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 69.43 | kJ/mol | Relay (... Calculated Property |
| IE | 8.36 | eV | Relay (... Calculated Property |
| log10WS | -3.71 | Relay (... Calculated Property | |
| logPoct/wat | 4.413 | Crippen Calculated Property | |
| McVol | 204.320 | ml/mol | McGowan Calculated Property |
| Pc | 1766.90 | kPa | Joback Calculated Property |
| Inp | 1547.00 | NIST | |
| I | 1927.00 | NIST | |
| Tboil | 520.76 | K | Relay (... Calculated Property |
| Tc | 717.43 | K | Relay (... Calculated Property |
| Tfus | 231.91 | K | Relay (... Calculated Property |
| Vc | 0.730 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [521.31; 618.26] | J/mol×K | [569.14; 763.20] | 
|
| Cp,gas | 521.31 | J/mol×K | 569.14 | Joback Calculated Property |
| Cp,gas | 539.68 | J/mol×K | 601.48 | Joback Calculated Property |
| Cp,gas | 557.00 | J/mol×K | 633.83 | Joback Calculated Property |
| Cp,gas | 573.39 | J/mol×K | 666.17 | Joback Calculated Property |
| Cp,gas | 588.99 | J/mol×K | 698.51 | Joback Calculated Property |
| Cp,gas | 603.90 | J/mol×K | 730.85 | Joback Calculated Property |
| Cp,gas | 618.26 | J/mol×K | 763.20 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to (E)-«beta»-10,11-Dihydro-10,11-epoxyfarnesene.
Sources
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