- InChI
- InChI=1S/C15H24O/c1-11(2)13-7-9-14(4)8-5-6-12(3)15(14,16)10-13/h13,16H,1,3,5-10H2,2,4H3/t13-,14?,15+/m0/s1
- InChI Key
- OEFZSVXJENLPRM-ZHDDOTHNSA-N
- Formula
- C15H24O
- SMILES
- C=C(C)C1CCC2(C)CCCC(=C)C2(O)C1
- 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.
- 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 | 0.4581 | Relay (1.0) Calculated Property | |
| ΔfG° | 125.38 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -238.59 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 11.29 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 77.00 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.62 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.85 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.840 | Crippen Calculated Property | |
| McVol | 197.760 | ml/mol | McGowan Calculated Property |
| Pc | 2304.74 | kPa | Joback Calculated Property |
| Inp | [1623.00; 1623.00] |
|
|
| Inp | 1623.00 | NIST | |
| Inp | 1623.00 | NIST | |
| Tboil | 558.36 | K | Relay (1.0) Calculated Property |
| Tc | 786.75 | K | Relay (1.0) Calculated Property |
| Tfus | 358.21 | K | Relay (1.0) Calculated Property |
| Vc | 0.667 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [567.87; 673.87] | J/mol×K | [656.87; 871.41] |
|
| Cp,gas | 567.87 | J/mol×K | 656.87 | Joback Calculated Property |
| Cp,gas | 586.89 | J/mol×K | 692.63 | Joback Calculated Property |
| Cp,gas | 605.07 | J/mol×K | 728.38 | Joback Calculated Property |
| Cp,gas | 622.64 | J/mol×K | 764.14 | Joback Calculated Property |
| Cp,gas | 639.81 | J/mol×K | 799.89 | Joback Calculated Property |
| Cp,gas | 656.81 | J/mol×K | 835.65 | Joback Calculated Property |
| Cp,gas | 673.87 | J/mol×K | 871.41 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to (+)-cis-Selina-4(15),11-dien-5-ol.
Sources
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