- InChI
- InChI=1S/C25H31ClO5/c1-3-4-5-6-7-8-11-16-30-24(27)21-12-9-10-13-22(21)25(28)31-18-19-14-15-20(26)17-23(19)29-2/h9-10,12-15,17H,3-8,11,16,18H2,1-2H3
- InChI Key
- CIIGJJAPZYFGLR-UHFFFAOYSA-N
- Formula
- C25H31ClO5
- SMILES
-
CCCCCCCCCOC(=O)c1ccccc1C(=O)OC
c1ccc(Cl)cc1OC - Molecular Weight1
- 446.96
- 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° | -229.22 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -758.24 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 58.38 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 102.89 | kJ/mol | Joback Calculated Property |
| log10WS | -8.22 | Crippen Calculated Property | |
| logPoct/wat | 6.613 | Crippen Calculated Property | |
| McVol | 348.580 | ml/mol | McGowan Calculated Property |
| Pc | 1139.03 | kPa | Joback Calculated Property |
| Inp | [3172.00; 3172.00] |
|
|
| Inp | 3172.00 | NIST | |
| Inp | 3172.00 | NIST | |
| Tboil | 1052.13 | K | Joback Calculated Property |
| Tc | 1288.64 | K | Joback Calculated Property |
| Tfus | 658.38 | K | Joback Calculated Property |
| Vc | 1.335 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1122.78; 1167.12] | J/mol×K | [1052.13; 1288.64] |
|
| Cp,gas | 1122.78 | J/mol×K | 1052.13 | Joback Calculated Property |
| Cp,gas | 1134.38 | J/mol×K | 1091.55 | Joback Calculated Property |
| Cp,gas | 1144.25 | J/mol×K | 1130.97 | Joback Calculated Property |
| Cp,gas | 1152.43 | J/mol×K | 1170.38 | Joback Calculated Property |
| Cp,gas | 1158.94 | J/mol×K | 1209.80 | Joback Calculated Property |
| Cp,gas | 1163.83 | J/mol×K | 1249.22 | Joback Calculated Property |
| Cp,gas | 1167.12 | J/mol×K | 1288.64 | Joback Calculated Property |
| η | [0.0000180; 0.0001398] | Pa×s | [658.38; 1052.13] |
|
| η | 0.0001398 | Pa×s | 658.38 | Joback Calculated Property |
| η | 0.0000851 | Pa×s | 724.01 | Joback Calculated Property |
| η | 0.0000562 | Pa×s | 789.63 | Joback Calculated Property |
| η | 0.0000396 | Pa×s | 855.25 | Joback Calculated Property |
| η | 0.0000293 | Pa×s | 920.88 | Joback Calculated Property |
| η | 0.0000226 | Pa×s | 986.50 | Joback Calculated Property |
| η | 0.0000180 | Pa×s | 1052.13 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Phthalic acid, 4-chloro-2-methoxybenzyl nonyl ester.
Sources
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