- InChI
- InChI=1S/C15H24O/c1-12-5-4-6-13(2)8-10-15(9-7-12)14(3)11-16/h5,8,16H,4,6-7,9-11H2,1-3H3/b12-5-,13-8-,15-14-
- InChI Key
- JEPRHCQQNHNKJV-MPLFWACNSA-N
- Formula
- C15H24O
- SMILES
- CC1=CCC(=C(C)CO)CCC(C)=CCC1
- 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° | -0.07 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -296.28 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 21.74 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 69.86 | kJ/mol | Joback Calculated Property |
| log10WS | -4.82 | Crippen Calculated Property | |
| logPoct/wat | 4.152 | Crippen Calculated Property | |
| McVol | 204.320 | ml/mol | McGowan Calculated Property |
| Pc | 2159.31 | kPa | Joback Calculated Property |
| Inp | [1694.00; 1700.00] |
|
|
| Inp | 1694.00 | NIST | |
| Inp | 1700.00 | NIST | |
| Tboil | 690.88 | K | Joback Calculated Property |
| Tc | 902.36 | K | Joback Calculated Property |
| Tfus | 340.13 | K | Joback Calculated Property |
| Vc | 0.752 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [571.26; 664.59] | J/mol×K | [690.88; 902.36] |
|
| Cp,gas | 571.26 | J/mol×K | 690.88 | Joback Calculated Property |
| Cp,gas | 589.63 | J/mol×K | 726.13 | Joback Calculated Property |
| Cp,gas | 606.85 | J/mol×K | 761.37 | Joback Calculated Property |
| Cp,gas | 622.95 | J/mol×K | 796.62 | Joback Calculated Property |
| Cp,gas | 637.92 | J/mol×K | 831.86 | Joback Calculated Property |
| Cp,gas | 651.80 | J/mol×K | 867.11 | Joback Calculated Property |
| Cp,gas | 664.59 | J/mol×K | 902.36 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Germacrene B alcohol.
Sources
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