- InChI
- InChI=1S/C15H24/c1-11(2)13-7-9-15(4)8-5-6-12(3)14(15)10-13/h10,12H,5-9H2,1-4H3/t12-,15+/m1/s1
- InChI Key
- ZQODGIAJYWHYRF-DOMZBBRYSA-N
- Formula
- C15H24
- SMILES
- CC(C)=C1C=C2C(C)CCCC2(C)CC1
- Molecular Weight1
- 204.35
- 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° | 200.27 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -104.18 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 16.02 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 50.17 | kJ/mol | Joback Calculated Property |
| log10WS | -5.11 | Crippen Calculated Property | |
| logPoct/wat | 4.869 | Crippen Calculated Property | |
| McVol | 191.890 | ml/mol | McGowan Calculated Property |
| Pc | 2069.88 | kPa | Joback Calculated Property |
| Inp | [1543.00; 1558.00] |
|
|
| Inp | 1558.00 | NIST | |
| Inp | 1543.00 | NIST | |
| Inp | 1558.00 | NIST | |
| Tboil | 584.06 | K | Joback Calculated Property |
| Tc | 811.24 | K | Joback Calculated Property |
| Tfus | 314.19 | K | Joback Calculated Property |
| Vc | 0.726 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [501.06; 617.92] | J/mol×K | [584.06; 811.24] |
|
| Cp,gas | 501.06 | J/mol×K | 584.06 | Joback Calculated Property |
| Cp,gas | 523.47 | J/mol×K | 621.92 | Joback Calculated Property |
| Cp,gas | 544.48 | J/mol×K | 659.79 | Joback Calculated Property |
| Cp,gas | 564.25 | J/mol×K | 697.65 | Joback Calculated Property |
| Cp,gas | 582.97 | J/mol×K | 735.51 | Joback Calculated Property |
| Cp,gas | 600.80 | J/mol×K | 773.38 | Joback Calculated Property |
| Cp,gas | 617.92 | J/mol×K | 811.24 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to (-)-Selina-5,7(11)-diene.
Sources
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