- InChI
- InChI=1S/C25H48O4/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-28-22(26)25(5,6)23(27)29-21-24(2,3)4/h7-21H2,1-6H3
- InChI Key
- MWFVGLDUTCWAOW-UHFFFAOYSA-N
- Formula
- C25H48O4
- SMILES
-
CCCCCCCCCCCCCCCOC(=O)C(C)(C)C(
=O)OCC(C)(C)C - Molecular Weight1
- 412.65
- 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° | -302.54 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1066.43 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 51.25 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 86.96 | kJ/mol | Joback Calculated Property |
| log10WS | -7.53 | Crippen Calculated Property | |
| logPoct/wat | 7.236 | Crippen Calculated Property | |
| McVol | 377.990 | ml/mol | McGowan Calculated Property |
| Pc | 821.95 | kPa | Joback Calculated Property |
| Inp | 2535.00 | NIST | |
| Tboil | 917.52 | K | Joback Calculated Property |
| Tc | 1123.40 | K | Joback Calculated Property |
| Tfus | 520.67 | K | Joback Calculated Property |
| Vc | 1.462 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1280.97; 1383.33] | J/mol×K | [917.52; 1123.40] | 
|
| Cp,gas | 1280.97 | J/mol×K | 917.52 | Joback Calculated Property |
| Cp,gas | 1301.07 | J/mol×K | 951.83 | Joback Calculated Property |
| Cp,gas | 1319.85 | J/mol×K | 986.15 | Joback Calculated Property |
| Cp,gas | 1337.39 | J/mol×K | 1020.46 | Joback Calculated Property |
| Cp,gas | 1353.77 | J/mol×K | 1054.78 | Joback Calculated Property |
| Cp,gas | 1369.06 | J/mol×K | 1089.09 | Joback Calculated Property |
| Cp,gas | 1383.33 | J/mol×K | 1123.40 | Joback Calculated Property |
| η | [0.0000150; 0.0003781] | Pa×s | [520.67; 917.52] |
|
| η | 0.0003781 | Pa×s | 520.67 | Joback Calculated Property |
| η | 0.0001631 | Pa×s | 586.81 | Joback Calculated Property |
| η | 0.0000835 | Pa×s | 652.95 | Joback Calculated Property |
| η | 0.0000483 | Pa×s | 719.10 | Joback Calculated Property |
| η | 0.0000307 | Pa×s | 785.24 | Joback Calculated Property |
| η | 0.0000209 | Pa×s | 851.38 | Joback Calculated Property |
| η | 0.0000150 | Pa×s | 917.52 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dimethylmalonic acid, neopentyl pentadecyl ester.
Sources
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