- InChI
- InChI=1S/C25H46O4/c1-5-6-7-8-9-10-11-12-13-14-15-20-28-23(26)25(3,4)24(27)29-22-18-16-21(2)17-19-22/h21-22H,5-20H2,1-4H3
- InChI Key
- PWQUAZPRRYIBNE-UHFFFAOYSA-N
- Formula
- C25H46O4
- SMILES
-
CCCCCCCCCCCCCOC(=O)C(C)(C)C(=O
)OC1CCC(C)CC1 - Molecular Weight1
- 410.63
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | -288.64 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1023.70 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 51.57 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 88.38 | kJ/mol | Joback Calculated Property |
| log10WS | -7.54 | Crippen Calculated Property | |
| logPoct/wat | 6.989 | Crippen Calculated Property | |
| McVol | 367.130 | ml/mol | McGowan Calculated Property |
| Pc | 899.10 | kPa | Joback Calculated Property |
| Inp | [2742.00; 2742.00] |
|
|
| Inp | 2742.00 | NIST | |
| Inp | 2742.00 | NIST | |
| Tboil | 935.63 | K | Joback Calculated Property |
| Tc | 1145.96 | K | Joback Calculated Property |
| Tfus | 521.39 | K | Joback Calculated Property |
| Vc | 1.405 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1282.12; 1378.14] | J/mol×K | [935.63; 1145.96] |
|
| Cp,gas | 1282.12 | J/mol×K | 935.63 | Joback Calculated Property |
| Cp,gas | 1301.98 | J/mol×K | 970.68 | Joback Calculated Property |
| Cp,gas | 1320.22 | J/mol×K | 1005.74 | Joback Calculated Property |
| Cp,gas | 1336.90 | J/mol×K | 1040.79 | Joback Calculated Property |
| Cp,gas | 1352.08 | J/mol×K | 1075.85 | Joback Calculated Property |
| Cp,gas | 1365.81 | J/mol×K | 1110.90 | Joback Calculated Property |
| Cp,gas | 1378.14 | J/mol×K | 1145.96 | Joback Calculated Property |
| η | [0.0000264; 0.0005231] | Pa×s | [521.39; 935.63] |
|
| η | 0.0005231 | Pa×s | 521.39 | Joback Calculated Property |
| η | 0.0002376 | Pa×s | 590.43 | Joback Calculated Property |
| η | 0.0001274 | Pa×s | 659.47 | Joback Calculated Property |
| η | 0.0000768 | Pa×s | 728.51 | Joback Calculated Property |
| η | 0.0000506 | Pa×s | 797.55 | Joback Calculated Property |
| η | 0.0000356 | Pa×s | 866.59 | Joback Calculated Property |
| η | 0.0000264 | Pa×s | 935.63 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dimethylmalonic acid, cis-4-methylcyclohexyl tridecyl ester.
Sources
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