- InChI
- InChI=1S/C15H24O/c1-11-5-4-7-15(3)8-6-13(9-14(11)15)12(2)10-16/h13,16H,2,4-10H2,1,3H3/t13-,15-/m0/s1
- InChI Key
- ITRHZWKEZJYJQO-ZFWWWQNUSA-N
- Formula
- C15H24O
- SMILES
- C=C(CO)C1CCC2(C)CCCC(C)=C2C1
- Molecular Weight1
- 220.35
- CAS
- 65018-14-6
- 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 | 0.5507 | Relay (... Calculated Property | |
| ΔfG° | 96.20 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -198.80 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 18.12 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 91.27 | kJ/mol | Relay (... Calculated Property |
| IE | 8.20 | eV | Relay (... Calculated Property |
| log10WS | -3.31 | Relay (... Calculated Property | |
| logPoct/wat | 3.842 | Crippen Calculated Property | |
| McVol | 197.760 | ml/mol | McGowan Calculated Property |
| Pc | 2250.40 | kPa | Joback Calculated Property |
| Inp | 1752.30 | NIST | |
| Tboil | 580.45 | K | Relay (... Calculated Property |
| Tc | 810.04 | K | Relay (... Calculated Property |
| Tfus | 335.42 | K | Relay (... Calculated Property |
| Vc | 0.660 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [569.97; 668.76] | J/mol×K | [671.26; 880.48] | 
|
| Cp,gas | 569.97 | J/mol×K | 671.26 | Joback Calculated Property |
| Cp,gas | 588.24 | J/mol×K | 706.13 | Joback Calculated Property |
| Cp,gas | 605.61 | J/mol×K | 741.00 | Joback Calculated Property |
| Cp,gas | 622.21 | J/mol×K | 775.87 | Joback Calculated Property |
| Cp,gas | 638.18 | J/mol×K | 810.74 | Joback Calculated Property |
| Cp,gas | 653.65 | J/mol×K | 845.61 | Joback Calculated Property |
| Cp,gas | 668.76 | J/mol×K | 880.48 | Joback Calculated Property |
Similar Compounds
Sources
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