- InChI
- InChI=1S/C15H22O2/c1-10-6-5-7-11-8-12(16)15(9-14(10,11)4)13(2,3)17-15/h5,7-8,10,12,16H,6,9H2,1-4H3/t10-,12+,14+,15-/m0/s1
- InChI Key
- IFTKMYUGODMWJL-BTQDYEIMSA-N
- Formula
- C15H22O2
- SMILES
-
CC1CC=CC2=CC(O)C3(CC21C)OC3(C)
C - Molecular Weight1
- 234.33
- 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.
- 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° | 16.83 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -328.11 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 20.08 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 67.60 | kJ/mol | Joback Calculated Property |
| log10WS | -3.70 | Crippen Calculated Property | |
| logPoct/wat | 2.827 | Crippen Calculated Property | |
| McVol | 192.770 | ml/mol | McGowan Calculated Property |
| Pc | 2540.49 | kPa | Joback Calculated Property |
| Inp | 1726.00 | NIST | |
| Tboil | 689.44 | K | Joback Calculated Property |
| Tc | 911.79 | K | Joback Calculated Property |
| Tfus | 466.72 | K | Joback Calculated Property |
| Vc | 0.727 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [582.67; 691.65] | J/mol×K | [689.44; 911.79] | 
|
| Cp,gas | 582.67 | J/mol×K | 689.44 | Joback Calculated Property |
| Cp,gas | 600.40 | J/mol×K | 726.50 | Joback Calculated Property |
| Cp,gas | 617.81 | J/mol×K | 763.56 | Joback Calculated Property |
| Cp,gas | 635.28 | J/mol×K | 800.61 | Joback Calculated Property |
| Cp,gas | 653.17 | J/mol×K | 837.67 | Joback Calculated Property |
| Cp,gas | 671.83 | J/mol×K | 874.73 | Joback Calculated Property |
| Cp,gas | 691.65 | J/mol×K | 911.79 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 7,11-Epoxy-eremophila-1,9-dien-8-«alpha»-ol.
Sources
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