- InChI
- InChI=1S/C14H26O4/c1-5-17-13(15)8-6-7-9-14(16)18-12(4)10-11(2)3/h11-12H,5-10H2,1-4H3
- InChI Key
- PEVVBDMNEZQQLN-UHFFFAOYSA-N
- Formula
- C14H26O4
- SMILES
- CCOC(=O)CCCCC(=O)OC(C)CC(C)C
- 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 | 0.7474 | Relay (1.0) Calculated Property | |
| ΔfG° | -558.62 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -989.61 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 33.71 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 78.06 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.50 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.96 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.088 | Crippen Calculated Property | |
| McVol | 223.000 | ml/mol | McGowan Calculated Property |
| Pc | 1554.90 | kPa | Joback Calculated Property |
| Inp | [1620.00; 1620.00] |
|
|
| Inp | 1620.00 | NIST | |
| Inp | 1620.00 | NIST | |
| Tboil | 540.09 | K | Relay (1.0) Calculated Property |
| Tc | 711.24 | K | Relay (1.0) Calculated Property |
| Tfus | 238.05 | K | Relay (1.0) Calculated Property |
| Vc | 0.843 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [609.31; 696.71] | J/mol×K | [635.48; 811.53] |
|
| Cp,gas | 609.31 | J/mol×K | 635.48 | Joback Calculated Property |
| Cp,gas | 625.90 | J/mol×K | 664.82 | Joback Calculated Property |
| Cp,gas | 641.67 | J/mol×K | 694.16 | Joback Calculated Property |
| Cp,gas | 656.63 | J/mol×K | 723.51 | Joback Calculated Property |
| Cp,gas | 670.79 | J/mol×K | 752.85 | Joback Calculated Property |
| Cp,gas | 684.14 | J/mol×K | 782.19 | Joback Calculated Property |
| Cp,gas | 696.71 | J/mol×K | 811.53 | Joback Calculated Property |
| η | [0.0000855; 0.0063664] | Pa×s | [302.20; 635.48] |
|
| η | 0.0063664 | Pa×s | 302.20 | Joback Calculated Property |
| η | 0.0017769 | Pa×s | 357.75 | Joback Calculated Property |
| η | 0.0006989 | Pa×s | 413.29 | Joback Calculated Property |
| η | 0.0003429 | Pa×s | 468.84 | Joback Calculated Property |
| η | 0.0001957 | Pa×s | 524.39 | Joback Calculated Property |
| η | 0.0001243 | Pa×s | 579.93 | Joback Calculated Property |
| η | 0.0000855 | Pa×s | 635.48 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Adipic acid, ethyl 4-methylpent-2-yl ester.
Sources
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