- InChI
- InChI=1S/C15H24O/c1-10(2)9-12-7-8-15(4)13(16)6-5-11(3)14(12)15/h12-14,16H,1,3,5-9H2,2,4H3/t12?,13-,14?,15+/m0/s1
- InChI Key
- HLVNRJLLBUWVCO-OOJKYFRXSA-N
- Formula
- C15H24O
- SMILES
- C=C(C)CC1CCC2(C)C(O)CCC(=C)C12
- Molecular Weight1
- 220.35
- 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° | 135.26 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -203.60 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 20.76 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 63.80 | kJ/mol | Joback Calculated Property |
| log10WS | -4.25 | Crippen Calculated Property | |
| logPoct/wat | 3.696 | Crippen Calculated Property | |
| McVol | 197.760 | ml/mol | McGowan Calculated Property |
| Pc | 2092.66 | kPa | Joback Calculated Property |
| Inp | [1642.00; 1642.00] |
|
|
| Inp | 1642.00 | NIST | |
| Inp | 1642.00 | NIST | |
| Tboil | 647.69 | K | Joback Calculated Property |
| Tc | 848.84 | K | Joback Calculated Property |
| Tfus | 358.33 | K | Joback Calculated Property |
| Vc | 0.747 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [570.56; 671.03] | J/mol×K | [647.69; 848.84] |
|
| Cp,gas | 570.56 | J/mol×K | 647.69 | Joback Calculated Property |
| Cp,gas | 589.28 | J/mol×K | 681.22 | Joback Calculated Property |
| Cp,gas | 607.05 | J/mol×K | 714.74 | Joback Calculated Property |
| Cp,gas | 623.99 | J/mol×K | 748.27 | Joback Calculated Property |
| Cp,gas | 640.23 | J/mol×K | 781.79 | Joback Calculated Property |
| Cp,gas | 655.87 | J/mol×K | 815.32 | Joback Calculated Property |
| Cp,gas | 671.03 | J/mol×K | 848.84 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Opposita-4(15),11-dien-1-«beta»-ol.
Sources
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