- InChI
- InChI=1S/C13H22O2/c1-5-13(14)15-10-9-12(4)8-6-7-11(2)3/h2,4-10H2,1,3H3
- InChI Key
- KRONWWNTASLWRC-UHFFFAOYSA-N
- Formula
- C13H22O2
- SMILES
- C=C(C)CCCC(=C)CCOC(=O)CC
- Molecular Weight1
- 210.31
- CAS
- 73214-63-8
- 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° | -16.76 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -325.17 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 27.03 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 52.51 | kJ/mol | Joback Calculated Property |
| log10WS | -3.83 | Crippen Calculated Property | |
| logPoct/wat | 3.632 | Crippen Calculated Property | |
| McVol | 192.870 | ml/mol | McGowan Calculated Property |
| Pc | 1848.33 | kPa | Joback Calculated Property |
| Inp | 1415.00 | NIST | |
| Tboil | 566.25 | K | Joback Calculated Property |
| Tc | 745.89 | K | Joback Calculated Property |
| Tfus | 276.99 | K | Joback Calculated Property |
| Vc | 0.751 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [473.39; 557.50] | J/mol×K | [566.25; 745.89] | 
|
| Cp,gas | 473.39 | J/mol×K | 566.25 | Joback Calculated Property |
| Cp,gas | 489.11 | J/mol×K | 596.19 | Joback Calculated Property |
| Cp,gas | 504.12 | J/mol×K | 626.13 | Joback Calculated Property |
| Cp,gas | 518.44 | J/mol×K | 656.07 | Joback Calculated Property |
| Cp,gas | 532.10 | J/mol×K | 686.01 | Joback Calculated Property |
| Cp,gas | 545.11 | J/mol×K | 715.95 | Joback Calculated Property |
| Cp,gas | 557.50 | J/mol×K | 745.89 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 7-Methyl-3-methylene-7-octen-1-ol, propanoate (ester).
Sources
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