- InChI
- InChI=1S/C29H39ClO5/c1-2-3-4-5-6-7-8-9-10-11-16-21-34-28(31)24-17-12-13-18-25(24)29(32)35-23-22-33-27-20-15-14-19-26(27)30/h12-15,17-20H,2-11,16,21-23H2,1H3
- InChI Key
- PQYKVGSVGAKUBW-UHFFFAOYSA-N
- Formula
- C29H39ClO5
- SMILES
-
CCCCCCCCCCCCCOC(=O)c1ccccc1C(=
O)OCCOc1ccccc1Cl - Molecular Weight1
- 503.07
- 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° | -185.91 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -829.33 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 69.13 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 111.13 | kJ/mol | Joback Calculated Property |
| log10WS | -9.43 | Crippen Calculated Property | |
| logPoct/wat | 8.044 | Crippen Calculated Property | |
| McVol | 404.940 | ml/mol | McGowan Calculated Property |
| Pc | 900.72 | kPa | Joback Calculated Property |
| Inp | 3681.00 | NIST | |
| Tboil | 1138.67 | K | Joback Calculated Property |
| Tc | 1399.41 | K | Joback Calculated Property |
| Tfus | 690.94 | K | Joback Calculated Property |
| Vc | 1.558 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1366.45; 1406.45] | J/mol×K | [1138.67; 1399.41] | 
|
| Cp,gas | 1366.45 | J/mol×K | 1138.67 | Joback Calculated Property |
| Cp,gas | 1378.13 | J/mol×K | 1182.13 | Joback Calculated Property |
| Cp,gas | 1387.70 | J/mol×K | 1225.58 | Joback Calculated Property |
| Cp,gas | 1395.23 | J/mol×K | 1269.04 | Joback Calculated Property |
| Cp,gas | 1400.82 | J/mol×K | 1312.49 | Joback Calculated Property |
| Cp,gas | 1404.53 | J/mol×K | 1355.95 | Joback Calculated Property |
| Cp,gas | 1406.45 | J/mol×K | 1399.41 | Joback Calculated Property |
| η | [0.0000093; 0.0000927] | Pa×s | [690.94; 1138.67] |
|
| η | 0.0000927 | Pa×s | 690.94 | Joback Calculated Property |
| η | 0.0000525 | Pa×s | 765.56 | Joback Calculated Property |
| η | 0.0000329 | Pa×s | 840.18 | Joback Calculated Property |
| η | 0.0000222 | Pa×s | 914.81 | Joback Calculated Property |
| η | 0.0000159 | Pa×s | 989.43 | Joback Calculated Property |
| η | 0.0000120 | Pa×s | 1064.05 | Joback Calculated Property |
| η | 0.0000093 | Pa×s | 1138.67 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Phthalic acid, 2-(4-chlorophenoxy)ethyl tridecyl ester.
Sources
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