- InChI
- InChI=1S/C14H26O4/c1-3-5-9-12-18-14(16)11-8-6-7-10-13(15)17-4-2/h3-12H2,1-2H3
- InChI Key
- DVSYQMUZHLOEMY-UHFFFAOYSA-N
- Formula
- C14H26O4
- SMILES
- CCCCCOC(=O)CCCCCC(=O)OCC
- Molecular Weight1
- 258.35
- ω : Acentric Factor.
- 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).
- 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 | 0.8258 | Relay (1.0) Calculated Property | |
| ΔfG° | -553.74 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -958.17 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 40.75 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 81.09 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.44 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.36 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.233 | Crippen Calculated Property | |
| McVol | 223.000 | ml/mol | McGowan Calculated Property |
| Pc | 1535.46 | kPa | Joback Calculated Property |
| Inp | [1781.00; 1781.00] |
|
|
| Inp | 1781.00 | NIST | |
| Inp | 1781.00 | NIST | |
| Tboil | 559.48 | K | Relay (1.0) Calculated Property |
| Tc | 730.30 | K | Relay (1.0) Calculated Property |
| Tfus | 250.79 | K | Relay (1.0) Calculated Property |
| Vc | 0.872 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [608.50; 693.46] | J/mol×K | [636.36; 807.35] |
|
| Cp,gas | 608.50 | J/mol×K | 636.36 | Joback Calculated Property |
| Cp,gas | 624.53 | J/mol×K | 664.86 | Joback Calculated Property |
| Cp,gas | 639.81 | J/mol×K | 693.36 | Joback Calculated Property |
| Cp,gas | 654.34 | J/mol×K | 721.85 | Joback Calculated Property |
| Cp,gas | 668.12 | J/mol×K | 750.35 | Joback Calculated Property |
| Cp,gas | 681.16 | J/mol×K | 778.85 | Joback Calculated Property |
| Cp,gas | 693.46 | J/mol×K | 807.35 | Joback Calculated Property |
| η | [0.0000987; 0.0031554] | Pa×s | [332.20; 636.36] |
|
| η | 0.0031554 | Pa×s | 332.20 | Joback Calculated Property |
| η | 0.0012085 | Pa×s | 382.89 | Joback Calculated Property |
| η | 0.0005793 | Pa×s | 433.59 | Joback Calculated Property |
| η | 0.0003239 | Pa×s | 484.28 | Joback Calculated Property |
| η | 0.0002022 | Pa×s | 534.97 | Joback Calculated Property |
| η | 0.0001369 | Pa×s | 585.67 | Joback Calculated Property |
| η | 0.0000987 | Pa×s | 636.36 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Pimelic acid, ethyl pentyl ester.
Sources
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