- InChI
- InChI=1S/C29H48O5/c1-6-9-10-11-12-13-14-15-16-17-20-23-32-27(30)29(7-2,8-3)28(31)34-26-22-19-18-21-25(26)33-24(4)5/h18-19,21-22,24H,6-17,20,23H2,1-5H3
- InChI Key
- WSCJOSDFYYVLSZ-UHFFFAOYSA-N
- Formula
- C29H48O5
- SMILES
-
CCCCCCCCCCCCCOC(=O)C(CC)(CC)C(
=O)Oc1ccccc1OC(C)C - Molecular Weight1
- 476.69
- 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° | -276.36 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1052.68 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 60.34 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 102.12 | kJ/mol | Joback Calculated Property |
| log10WS | -9.01 | Crippen Calculated Property | |
| logPoct/wat | 8.040 | Crippen Calculated Property | |
| McVol | 416.460 | ml/mol | McGowan Calculated Property |
| Pc | 778.51 | kPa | Joback Calculated Property |
| Inp | [3049.00; 3049.00] |
|
|
| Inp | 3049.00 | NIST | |
| Inp | 3049.00 | NIST | |
| Tboil | 1065.91 | K | Joback Calculated Property |
| Tc | 1311.45 | K | Joback Calculated Property |
| Tfus | 609.50 | K | Joback Calculated Property |
| Vc | 1.601 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1461.72; 1538.53] | J/mol×K | [1065.91; 1311.45] |
|
| Cp,gas | 1461.72 | J/mol×K | 1065.91 | Joback Calculated Property |
| Cp,gas | 1479.08 | J/mol×K | 1106.83 | Joback Calculated Property |
| Cp,gas | 1494.49 | J/mol×K | 1147.76 | Joback Calculated Property |
| Cp,gas | 1508.05 | J/mol×K | 1188.68 | Joback Calculated Property |
| Cp,gas | 1519.85 | J/mol×K | 1229.60 | Joback Calculated Property |
| Cp,gas | 1529.98 | J/mol×K | 1270.52 | Joback Calculated Property |
| Cp,gas | 1538.53 | J/mol×K | 1311.45 | Joback Calculated Property |
| η | [0.0000071; 0.0001312] | Pa×s | [609.50; 1065.91] |
|
| η | 0.0001312 | Pa×s | 609.50 | Joback Calculated Property |
| η | 0.0000615 | Pa×s | 685.57 | Joback Calculated Property |
| η | 0.0000336 | Pa×s | 761.64 | Joback Calculated Property |
| η | 0.0000204 | Pa×s | 837.70 | Joback Calculated Property |
| η | 0.0000135 | Pa×s | 913.77 | Joback Calculated Property |
| η | 0.0000095 | Pa×s | 989.84 | Joback Calculated Property |
| η | 0.0000071 | Pa×s | 1065.91 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, 2-isopropoxyphenyl tridecyl ester.
Sources
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