- InChI
- InChI=1S/C33H56O4/c1-6-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-27-36-31(34)33(7-2,8-3)32(35)37-30-26-24-25-28(4)29(30)5/h24-26H,6-23,27H2,1-5H3
- InChI Key
- OBSBAGVOWWHCKG-UHFFFAOYSA-N
- Formula
- C33H56O4
- SMILES
-
CCCCCCCCCCCCCCCCCCOC(=O)C(CC)(
CC)C(=O)Oc1cccc(C)c1C - Molecular Weight1
- 516.80
- 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° | -144.87 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1009.21 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 72.65 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 109.67 | kJ/mol | Joback Calculated Property |
| log10WS | -10.99 | Crippen Calculated Property | |
| logPoct/wat | 9.820 | Crippen Calculated Property | |
| McVol | 466.950 | ml/mol | McGowan Calculated Property |
| Pc | 633.20 | kPa | Joback Calculated Property |
| Inp | 3548.00 | NIST | |
| Tboil | 1140.43 | K | Joback Calculated Property |
| Tc | 1426.12 | K | Joback Calculated Property |
| Tfus | 659.87 | K | Joback Calculated Property |
| Vc | 1.812 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1689.24; 1781.29] | J/mol×K | [1140.43; 1426.12] | 
|
| Cp,gas | 1689.24 | J/mol×K | 1140.43 | Joback Calculated Property |
| Cp,gas | 1709.68 | J/mol×K | 1188.05 | Joback Calculated Property |
| Cp,gas | 1727.81 | J/mol×K | 1235.66 | Joback Calculated Property |
| Cp,gas | 1743.85 | J/mol×K | 1283.28 | Joback Calculated Property |
| Cp,gas | 1757.97 | J/mol×K | 1330.89 | Joback Calculated Property |
| Cp,gas | 1770.39 | J/mol×K | 1378.51 | Joback Calculated Property |
| Cp,gas | 1781.29 | J/mol×K | 1426.12 | Joback Calculated Property |
| η | [0.0000057; 0.0000905] | Pa×s | [659.87; 1140.43] |
|
| η | 0.0000905 | Pa×s | 659.87 | Joback Calculated Property |
| η | 0.0000445 | Pa×s | 739.96 | Joback Calculated Property |
| η | 0.0000252 | Pa×s | 820.06 | Joback Calculated Property |
| η | 0.0000157 | Pa×s | 900.15 | Joback Calculated Property |
| η | 0.0000106 | Pa×s | 980.24 | Joback Calculated Property |
| η | 0.0000076 | Pa×s | 1060.34 | Joback Calculated Property |
| η | 0.0000057 | Pa×s | 1140.43 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, 2,3-dimethylphenyl octadecyl ester.
Sources
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