- InChI
- InChI=1S/C23H36O4/c1-4-7-8-9-13-18-26-21(24)23(5-2,6-3)22(25)27-19-14-17-20-15-11-10-12-16-20/h10-12,15-16H,4-9,13-14,17-19H2,1-3H3
- InChI Key
- QKCRZNPKMVRGEA-UHFFFAOYSA-N
- Formula
- C23H36O4
- SMILES
-
CCCCCCCOC(=O)C(CC)(CC)C(=O)OCC
Cc1ccccc1 - Molecular Weight1
- 376.53
- 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° | -209.81 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -779.87 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 47.53 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 86.08 | kJ/mol | Joback Calculated Property |
| log10WS | -6.04 | Crippen Calculated Property | |
| logPoct/wat | 5.482 | Crippen Calculated Property | |
| McVol | 326.050 | ml/mol | McGowan Calculated Property |
| Pc | 1123.06 | kPa | Joback Calculated Property |
| Inp | 2499.00 | NIST | |
| Tboil | 901.67 | K | Joback Calculated Property |
| Tc | 1108.90 | K | Joback Calculated Property |
| Tfus | 522.13 | K | Joback Calculated Property |
| Vc | 1.252 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1058.97; 1143.01] | J/mol×K | [901.67; 1108.90] | 
|
| Cp,gas | 1058.97 | J/mol×K | 901.67 | Joback Calculated Property |
| Cp,gas | 1075.88 | J/mol×K | 936.21 | Joback Calculated Property |
| Cp,gas | 1091.55 | J/mol×K | 970.75 | Joback Calculated Property |
| Cp,gas | 1106.04 | J/mol×K | 1005.28 | Joback Calculated Property |
| Cp,gas | 1119.41 | J/mol×K | 1039.82 | Joback Calculated Property |
| Cp,gas | 1131.71 | J/mol×K | 1074.36 | Joback Calculated Property |
| Cp,gas | 1143.01 | J/mol×K | 1108.90 | Joback Calculated Property |
| η | [0.0000272; 0.0004518] | Pa×s | [522.13; 901.67] |
|
| η | 0.0004518 | Pa×s | 522.13 | Joback Calculated Property |
| η | 0.0002196 | Pa×s | 585.39 | Joback Calculated Property |
| η | 0.0001228 | Pa×s | 648.64 | Joback Calculated Property |
| η | 0.0000762 | Pa×s | 711.90 | Joback Calculated Property |
| η | 0.0000511 | Pa×s | 775.16 | Joback Calculated Property |
| η | 0.0000364 | Pa×s | 838.41 | Joback Calculated Property |
| η | 0.0000272 | Pa×s | 901.67 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, heptyl 3-phenylpropyl ester.
Sources
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