- InChI
- InChI=1S/C20H38O4/c1-6-7-8-9-10-11-12-15-23-18(21)20(4,5)19(22)24-16-13-14-17(2)3/h17H,6-16H2,1-5H3
- InChI Key
- OMMHNXIKOUVUEP-UHFFFAOYSA-N
- Formula
- C20H38O4
- SMILES
-
CCCCCCCCCOC(=O)C(C)(C)C(=O)OCC
CC(C)C - Molecular Weight1
- 342.52
- 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 | 0.9163 | Relay (1.0) Calculated Property | |
| ΔfG° | -502.82 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1088.29 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 45.36 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 89.57 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.76 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.38 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.286 | Crippen Calculated Property | |
| McVol | 307.540 | ml/mol | McGowan Calculated Property |
| Pc | 1039.91 | kPa | Joback Calculated Property |
| Inp | [2082.00; 2082.00] |
|
|
| Inp | 2082.00 | NIST | |
| Inp | 2082.00 | NIST | |
| Tboil | 584.95 | K | Relay (1.0) Calculated Property |
| Tc | 776.64 | K | Relay (1.0) Calculated Property |
| Tfus | 255.35 | K | Relay (1.0) Calculated Property |
| Vc | 1.179 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [953.83; 1049.65] | J/mol×K | [769.97; 951.03] |
|
| Cp,gas | 953.83 | J/mol×K | 769.97 | Joback Calculated Property |
| Cp,gas | 972.47 | J/mol×K | 800.15 | Joback Calculated Property |
| Cp,gas | 990.00 | J/mol×K | 830.32 | Joback Calculated Property |
| Cp,gas | 1006.45 | J/mol×K | 860.50 | Joback Calculated Property |
| Cp,gas | 1021.86 | J/mol×K | 890.68 | Joback Calculated Property |
| Cp,gas | 1036.24 | J/mol×K | 920.86 | Joback Calculated Property |
| Cp,gas | 1049.65 | J/mol×K | 951.03 | Joback Calculated Property |
| η | [0.0000315; 0.0020473] | Pa×s | [387.24; 769.97] |
|
| η | 0.0020473 | Pa×s | 387.24 | Joback Calculated Property |
| η | 0.0006244 | Pa×s | 451.03 | Joback Calculated Property |
| η | 0.0002556 | Pa×s | 514.82 | Joback Calculated Property |
| η | 0.0001274 | Pa×s | 578.61 | Joback Calculated Property |
| η | 0.0000729 | Pa×s | 642.39 | Joback Calculated Property |
| η | 0.0000462 | Pa×s | 706.18 | Joback Calculated Property |
| η | 0.0000315 | Pa×s | 769.97 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dimethylmalonic acid, isohexyl nonyl ester.
Sources
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