- InChI
- InChI=1S/C29H39ClO4/c1-3-4-5-6-7-8-9-10-11-12-13-16-21-33-28(31)25-17-14-15-18-26(25)29(32)34-27-20-19-24(30)22-23(27)2/h14-15,17-20,22H,3-13,16,21H2,1-2H3
- InChI Key
- JXIUUQBIIMUKJG-UHFFFAOYSA-N
- Formula
- C29H39ClO4
- SMILES
-
CCCCCCCCCCCCCCOC(=O)c1ccccc1C(
=O)Oc1ccc(Cl)cc1C - Molecular Weight1
- 487.07
- 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° | -90.54 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -708.58 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 67.55 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 109.38 | kJ/mol | Joback Calculated Property |
| log10WS | -10.40 | Crippen Calculated Property | |
| logPoct/wat | 8.726 | Crippen Calculated Property | |
| McVol | 399.070 | ml/mol | McGowan Calculated Property |
| Pc | 901.80 | kPa | Joback Calculated Property |
| Inp | [3558.00; 3558.00] |
|
|
| Inp | 3558.00 | NIST | |
| Inp | 3558.00 | NIST | |
| Tboil | 1121.23 | K | Joback Calculated Property |
| Tc | 1375.45 | K | Joback Calculated Property |
| Tfus | 681.23 | K | Joback Calculated Property |
| Vc | 1.540 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1341.00; 1394.16] | J/mol×K | [1121.23; 1375.45] |
|
| Cp,gas | 1341.00 | J/mol×K | 1121.23 | Joback Calculated Property |
| Cp,gas | 1354.13 | J/mol×K | 1163.60 | Joback Calculated Property |
| Cp,gas | 1365.43 | J/mol×K | 1205.97 | Joback Calculated Property |
| Cp,gas | 1374.99 | J/mol×K | 1248.34 | Joback Calculated Property |
| Cp,gas | 1382.91 | J/mol×K | 1290.71 | Joback Calculated Property |
| Cp,gas | 1389.27 | J/mol×K | 1333.08 | Joback Calculated Property |
| Cp,gas | 1394.16 | J/mol×K | 1375.45 | Joback Calculated Property |
| η | [0.0000132; 0.0001223] | Pa×s | [681.23; 1121.23] |
|
| η | 0.0001223 | Pa×s | 681.23 | Joback Calculated Property |
| η | 0.0000705 | Pa×s | 754.56 | Joback Calculated Property |
| η | 0.0000448 | Pa×s | 827.90 | Joback Calculated Property |
| η | 0.0000306 | Pa×s | 901.23 | Joback Calculated Property |
| η | 0.0000222 | Pa×s | 974.56 | Joback Calculated Property |
| η | 0.0000168 | Pa×s | 1047.90 | Joback Calculated Property |
| η | 0.0000132 | Pa×s | 1121.23 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Phthalic acid, 4-chloro-2-methylphenyl tetradecyl ester.
Sources
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