- InChI
- InChI=1S/C27H43ClO4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18-21-31-26(29)24-19-16-17-20-25(24)27(30)32-22-23(2)28/h16-17,19-20,23H,3-15,18,21-22H2,1-2H3
- InChI Key
- SAJJLQJCDWMVHK-UHFFFAOYSA-N
- Formula
- C27H43ClO4
- SMILES
-
CCCCCCCCCCCCCCCCOC(=O)c1ccccc1
C(=O)OCC(C)Cl - Molecular Weight1
- 467.08
- 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° | -202.97 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -886.17 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 65.59 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 100.94 | kJ/mol | Joback Calculated Property |
| log10WS | -9.34 | Crippen Calculated Property | |
| logPoct/wat | 8.109 | Crippen Calculated Property | |
| McVol | 394.650 | ml/mol | McGowan Calculated Property |
| Pc | 849.49 | kPa | Joback Calculated Property |
| Inp | [3274.00; 3274.00] |
|
|
| Inp | 3274.00 | NIST | |
| Inp | 3274.00 | NIST | |
| Tboil | 1038.39 | K | Joback Calculated Property |
| Tc | 1274.58 | K | Joback Calculated Property |
| Tfus | 592.23 | K | Joback Calculated Property |
| Vc | 1.530 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1332.45; 1407.54] | J/mol×K | [1038.39; 1274.58] |
|
| Cp,gas | 1332.45 | J/mol×K | 1038.39 | Joback Calculated Property |
| Cp,gas | 1349.03 | J/mol×K | 1077.76 | Joback Calculated Property |
| Cp,gas | 1363.88 | J/mol×K | 1117.12 | Joback Calculated Property |
| Cp,gas | 1377.09 | J/mol×K | 1156.49 | Joback Calculated Property |
| Cp,gas | 1388.73 | J/mol×K | 1195.85 | Joback Calculated Property |
| Cp,gas | 1398.85 | J/mol×K | 1235.22 | Joback Calculated Property |
| Cp,gas | 1407.54 | J/mol×K | 1274.58 | Joback Calculated Property |
| η | [0.0000148; 0.0002302] | Pa×s | [592.23; 1038.39] |
|
| η | 0.0002302 | Pa×s | 592.23 | Joback Calculated Property |
| η | 0.0001129 | Pa×s | 666.59 | Joback Calculated Property |
| η | 0.0000639 | Pa×s | 740.95 | Joback Calculated Property |
| η | 0.0000401 | Pa×s | 815.31 | Joback Calculated Property |
| η | 0.0000272 | Pa×s | 889.67 | Joback Calculated Property |
| η | 0.0000196 | Pa×s | 964.03 | Joback Calculated Property |
| η | 0.0000148 | Pa×s | 1038.39 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Phthalic acid, 2-chloropropyl hexadecyl ester.
Sources
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