- InChI
- InChI=1S/C23H44O4/c1-6-7-8-9-10-11-12-13-14-15-18-26-21(24)23(4,5)22(25)27-19-16-17-20(2)3/h20H,6-19H2,1-5H3
- InChI Key
- QXYWORJUOCBWQX-UHFFFAOYSA-N
- Formula
- C23H44O4
- SMILES
-
CCCCCCCCCCCCOC(=O)C(C)(C)C(=O)
OCCCC(C)C - Molecular Weight1
- 384.59
- 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 | 1.0232 | Relay (1.0) Calculated Property | |
| ΔfG° | -477.56 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1147.89 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 53.13 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 101.44 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.84 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.33 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.456 | Crippen Calculated Property | |
| McVol | 349.810 | ml/mol | McGowan Calculated Property |
| Pc | 870.68 | kPa | Joback Calculated Property |
| Inp | 2376.00 | NIST | |
| Tboil | 608.34 | K | Relay (1.0) Calculated Property |
| Tc | 800.56 | K | Relay (1.0) Calculated Property |
| Tfus | 269.27 | K | Relay (1.0) Calculated Property |
| Vc | 1.345 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1137.18; 1236.01] | J/mol×K | [838.61; 1027.69] | 
|
| Cp,gas | 1137.18 | J/mol×K | 838.61 | Joback Calculated Property |
| Cp,gas | 1156.69 | J/mol×K | 870.12 | Joback Calculated Property |
| Cp,gas | 1174.93 | J/mol×K | 901.64 | Joback Calculated Property |
| Cp,gas | 1191.94 | J/mol×K | 933.15 | Joback Calculated Property |
| Cp,gas | 1207.76 | J/mol×K | 964.66 | Joback Calculated Property |
| Cp,gas | 1222.44 | J/mol×K | 996.17 | Joback Calculated Property |
| Cp,gas | 1236.01 | J/mol×K | 1027.69 | Joback Calculated Property |
| η | [0.0000193; 0.0012612] | Pa×s | [421.05; 838.61] |
|
| η | 0.0012612 | Pa×s | 421.05 | Joback Calculated Property |
| η | 0.0003835 | Pa×s | 490.64 | Joback Calculated Property |
| η | 0.0001567 | Pa×s | 560.24 | Joback Calculated Property |
| η | 0.0000781 | Pa×s | 629.83 | Joback Calculated Property |
| η | 0.0000447 | Pa×s | 699.42 | Joback Calculated Property |
| η | 0.0000283 | Pa×s | 769.02 | Joback Calculated Property |
| η | 0.0000193 | Pa×s | 838.61 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dimethylmalonic acid, dodecyl isohexyl ester.
Sources
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