- InChI
- InChI=1S/C26H42O4/c1-4-5-6-7-8-9-10-11-12-16-21-29-24(27)26(2,3)25(28)30-22-17-20-23-18-14-13-15-19-23/h13-15,18-19H,4-12,16-17,20-22H2,1-3H3
- InChI Key
- QPFJTHGMDKGRNC-UHFFFAOYSA-N
- Formula
- C26H42O4
- SMILES
-
CCCCCCCCCCCCOC(=O)C(C)(C)C(=O)
OCCCc1ccccc1 - Molecular Weight1
- 418.62
- 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).
- 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 | 1.0904 | Relay (1.0) Calculated Property | |
| ΔfG° | -337.45 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -946.45 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 58.46 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 119.70 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.10 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.64 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.653 | Crippen Calculated Property | |
| McVol | 368.320 | ml/mol | McGowan Calculated Property |
| Pc | 888.94 | kPa | Joback Calculated Property |
| Tboil | 663.85 | K | Relay (1.0) Calculated Property |
| Tc | 872.33 | K | Relay (1.0) Calculated Property |
| Tfus | 284.46 | K | Relay (1.0) Calculated Property |
| Vc | 1.391 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1228.05; 1313.49] | J/mol×K | [934.37; 1144.36] | 
|
| Cp,gas | 1228.05 | J/mol×K | 934.37 | Joback Calculated Property |
| Cp,gas | 1245.64 | J/mol×K | 969.37 | Joback Calculated Property |
| Cp,gas | 1261.79 | J/mol×K | 1004.37 | Joback Calculated Property |
| Cp,gas | 1276.58 | J/mol×K | 1039.36 | Joback Calculated Property |
| Cp,gas | 1290.08 | J/mol×K | 1074.36 | Joback Calculated Property |
| Cp,gas | 1302.36 | J/mol×K | 1109.36 | Joback Calculated Property |
| Cp,gas | 1313.49 | J/mol×K | 1144.36 | Joback Calculated Property |
| η | [0.0000130; 0.0004761] | Pa×s | [496.28; 934.37] |
|
| η | 0.0004761 | Pa×s | 496.28 | Joback Calculated Property |
| η | 0.0001778 | Pa×s | 569.29 | Joback Calculated Property |
| η | 0.0000830 | Pa×s | 642.31 | Joback Calculated Property |
| η | 0.0000453 | Pa×s | 715.32 | Joback Calculated Property |
| η | 0.0000277 | Pa×s | 788.34 | Joback Calculated Property |
| η | 0.0000184 | Pa×s | 861.35 | Joback Calculated Property |
| η | 0.0000130 | Pa×s | 934.37 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dimethylmalonic acid, dodecyl 3-phenylpropyl ester.
Sources
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