- InChI
- InChI=1S/C23H34O5/c1-5-8-9-10-11-12-17-27-21(25)23(6-2,7-3)22(26)28-20-15-13-19(14-16-20)18(4)24/h13-16H,5-12,17H2,1-4H3
- InChI Key
- MOTSDYSVCKWWHT-UHFFFAOYSA-N
- Formula
- C23H34O5
- SMILES
-
CCCCCCCCOC(=O)C(CC)(CC)C(=O)Oc
1ccc(C(C)=O)cc1 - Molecular Weight1
- 390.51
- 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° | -348.36 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -903.92 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 48.74 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 93.49 | kJ/mol | Joback Calculated Property |
| log10WS | -6.51 | Crippen Calculated Property | |
| logPoct/wat | 5.505 | Crippen Calculated Property | |
| McVol | 327.620 | ml/mol | McGowan Calculated Property |
| Pc | 1160.08 | kPa | Joback Calculated Property |
| Inp | [2705.00; 2705.00] |
|
|
| Inp | 2705.00 | NIST | |
| Inp | 2705.00 | NIST | |
| Tboil | 960.52 | K | Joback Calculated Property |
| Tc | 1178.29 | K | Joback Calculated Property |
| Tfus | 584.58 | K | Joback Calculated Property |
| Vc | 1.258 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1073.70; 1144.98] | J/mol×K | [960.52; 1178.29] |
|
| Cp,gas | 1073.70 | J/mol×K | 960.52 | Joback Calculated Property |
| Cp,gas | 1088.63 | J/mol×K | 996.81 | Joback Calculated Property |
| Cp,gas | 1102.27 | J/mol×K | 1033.11 | Joback Calculated Property |
| Cp,gas | 1114.66 | J/mol×K | 1069.40 | Joback Calculated Property |
| Cp,gas | 1125.88 | J/mol×K | 1105.70 | Joback Calculated Property |
| Cp,gas | 1135.96 | J/mol×K | 1141.99 | Joback Calculated Property |
| Cp,gas | 1144.98 | J/mol×K | 1178.29 | Joback Calculated Property |
| η | [0.0000257; 0.0003027] | Pa×s | [584.58; 960.52] |
|
| η | 0.0003027 | Pa×s | 584.58 | Joback Calculated Property |
| η | 0.0001645 | Pa×s | 647.24 | Joback Calculated Property |
| η | 0.0000996 | Pa×s | 709.89 | Joback Calculated Property |
| η | 0.0000654 | Pa×s | 772.55 | Joback Calculated Property |
| η | 0.0000457 | Pa×s | 835.21 | Joback Calculated Property |
| η | 0.0000336 | Pa×s | 897.86 | Joback Calculated Property |
| η | 0.0000257 | Pa×s | 960.52 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, 4-acetylphenyl octyl ester.
Sources
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