- InChI
- InChI=1S/C15H28O2/c1-5-14(4)12-17-15(16)11-9-7-6-8-10-13(2)3/h8,10,13-14H,5-7,9,11-12H2,1-4H3/b10-8+
- InChI Key
- PLTRJLWIJLCEOL-CSKARUKUSA-N
- Formula
- C15H28O2
- SMILES
- CCC(C)COC(=O)CCCCC=CC(C)C
- Molecular Weight1
- 240.38
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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° | -83.16 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -491.07 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 30.55 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 57.32 | kJ/mol | Joback Calculated Property |
| log10WS | -4.33 | Crippen Calculated Property | |
| logPoct/wat | 4.348 | Crippen Calculated Property | |
| McVol | 225.350 | ml/mol | McGowan Calculated Property |
| Pc | 1545.13 | kPa | Joback Calculated Property |
| Inp | [1545.20; 1545.20] |
|
|
| Inp | 1545.20 | NIST | |
| Inp | 1545.20 | NIST | |
| Tboil | 622.17 | K | Joback Calculated Property |
| Tc | 800.65 | K | Joback Calculated Property |
| Tfus | 295.89 | K | Joback Calculated Property |
| Vc | 0.868 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [601.34; 695.44] | J/mol×K | [622.17; 800.65] |
|
| Cp,gas | 601.34 | J/mol×K | 622.17 | Joback Calculated Property |
| Cp,gas | 618.98 | J/mol×K | 651.92 | Joback Calculated Property |
| Cp,gas | 635.80 | J/mol×K | 681.66 | Joback Calculated Property |
| Cp,gas | 651.84 | J/mol×K | 711.41 | Joback Calculated Property |
| Cp,gas | 667.11 | J/mol×K | 741.15 | Joback Calculated Property |
| Cp,gas | 681.63 | J/mol×K | 770.90 | Joback Calculated Property |
| Cp,gas | 695.44 | J/mol×K | 800.65 | Joback Calculated Property |
| η | [0.0001019; 0.0045474] | Pa×s | [295.89; 622.17] |
|
| η | 0.0045474 | Pa×s | 295.89 | Joback Calculated Property |
| η | 0.0014772 | Pa×s | 350.27 | Joback Calculated Property |
| η | 0.0006492 | Pa×s | 404.65 | Joback Calculated Property |
| η | 0.0003466 | Pa×s | 459.03 | Joback Calculated Property |
| η | 0.0002114 | Pa×s | 513.41 | Joback Calculated Property |
| η | 0.0001417 | Pa×s | 567.79 | Joback Calculated Property |
| η | 0.0001019 | Pa×s | 622.17 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Methylbutyl 8-methylnon-6-enoate.
Sources
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