- InChI
- InChI=1S/C10H18O2/c1-3-5-7-10(4-2)8-6-9(11)12-10/h3-8H2,1-2H3
- InChI Key
- KPODJTXDIIOWSY-UHFFFAOYSA-N
- Formula
- C10H18O2
- SMILES
- CCCCC1(CC)CCC(=O)O1
- Molecular Weight1
- 170.25
- 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.
- I : 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° | -144.33 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -443.71 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 16.78 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 45.72 | kJ/mol | Joback Calculated Property |
| log10WS | -2.88 | Crippen Calculated Property | |
| logPoct/wat | 2.662 | Crippen Calculated Property | |
| McVol | 148.340 | ml/mol | McGowan Calculated Property |
| Pc | 2693.00 | kPa | Joback Calculated Property |
| Inp | [1359.00; 1359.00] |
|
|
| Inp | 1359.00 | NIST | |
| Inp | 1359.00 | NIST | |
| I | [1950.00; 1950.00] |
|
|
| I | 1950.00 | NIST | |
| I | 1950.00 | NIST | |
| Tboil | 538.49 | K | Joback Calculated Property |
| Tc | 751.28 | K | Joback Calculated Property |
| Tfus | 332.05 | K | Joback Calculated Property |
| Vc | 0.562 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [369.66; 459.88] | J/mol×K | [538.49; 751.28] |
|
| Cp,gas | 369.66 | J/mol×K | 538.49 | Joback Calculated Property |
| Cp,gas | 386.70 | J/mol×K | 573.96 | Joback Calculated Property |
| Cp,gas | 402.83 | J/mol×K | 609.42 | Joback Calculated Property |
| Cp,gas | 418.12 | J/mol×K | 644.89 | Joback Calculated Property |
| Cp,gas | 432.67 | J/mol×K | 680.35 | Joback Calculated Property |
| Cp,gas | 446.56 | J/mol×K | 715.82 | Joback Calculated Property |
| Cp,gas | 459.88 | J/mol×K | 751.28 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4-Ethyl-4-octanolide.
Sources
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