- InChI
- InChI=1S/C14H26O2/c1-2-3-4-7-12-16-14(15)11-10-13-8-5-6-9-13/h13H,2-12H2,1H3
- InChI Key
- KGSNANUYCZAHJK-UHFFFAOYSA-N
- Formula
- C14H26O2
- SMILES
- CCCCCCOC(=O)CCC1CCCC1
- Molecular Weight1
- 226.35
- 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° | -130.37 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -516.61 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 28.74 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 56.17 | kJ/mol | Joback Calculated Property |
| log10WS | -4.20 | Crippen Calculated Property | |
| logPoct/wat | 4.080 | Crippen Calculated Property | |
| McVol | 204.700 | ml/mol | McGowan Calculated Property |
| Pc | 1832.54 | kPa | Joback Calculated Property |
| Inp | [1664.80; 1664.80] |
|
|
| Inp | 1664.80 | NIST | |
| Inp | 1664.80 | NIST | |
| Tboil | 611.29 | K | Joback Calculated Property |
| Tc | 799.78 | K | Joback Calculated Property |
| Tfus | 330.60 | K | Joback Calculated Property |
| Vc | 0.784 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [557.74; 658.28] | J/mol×K | [611.29; 799.78] |
|
| Cp,gas | 557.74 | J/mol×K | 611.29 | Joback Calculated Property |
| Cp,gas | 576.80 | J/mol×K | 642.71 | Joback Calculated Property |
| Cp,gas | 594.90 | J/mol×K | 674.12 | Joback Calculated Property |
| Cp,gas | 612.08 | J/mol×K | 705.54 | Joback Calculated Property |
| Cp,gas | 628.35 | J/mol×K | 736.95 | Joback Calculated Property |
| Cp,gas | 643.74 | J/mol×K | 768.37 | Joback Calculated Property |
| Cp,gas | 658.28 | J/mol×K | 799.78 | Joback Calculated Property |
| η | [0.0002144; 0.0030337] | Pa×s | [330.60; 611.29] |
|
| η | 0.0030337 | Pa×s | 330.60 | Joback Calculated Property |
| η | 0.0014835 | Pa×s | 377.38 | Joback Calculated Property |
| η | 0.0008494 | Pa×s | 424.16 | Joback Calculated Property |
| η | 0.0005434 | Pa×s | 470.94 | Joback Calculated Property |
| η | 0.0003768 | Pa×s | 517.73 | Joback Calculated Property |
| η | 0.0002776 | Pa×s | 564.51 | Joback Calculated Property |
| η | 0.0002144 | Pa×s | 611.29 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-Cyclopentylpropionic acid, hexyl ester.
Sources
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