- InChI
- InChI=1S/C30H41ClO4/c1-2-3-4-5-6-7-8-9-10-11-12-15-22-34-29(32)27-19-13-14-20-28(27)30(33)35-23-21-25-17-16-18-26(31)24-25/h13-14,16-20,24H,2-12,15,21-23H2,1H3
- InChI Key
- DAPQZYUCVZACJQ-UHFFFAOYSA-N
- Formula
- C30H41ClO4
- SMILES
-
CCCCCCCCCCCCCCOC(=O)c1ccccc1C(
=O)OCCc1cccc(Cl)c1 - Molecular Weight1
- 501.10
- 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° | -72.49 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -717.75 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 70.53 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 110.95 | kJ/mol | Joback Calculated Property |
| log10WS | -10.12 | Crippen Calculated Property | |
| logPoct/wat | 8.597 | Crippen Calculated Property | |
| McVol | 413.160 | ml/mol | McGowan Calculated Property |
| Pc | 859.48 | kPa | Joback Calculated Property |
| Inp | [3712.00; 3712.00] |
|
|
| Inp | 3712.00 | NIST | |
| Inp | 3712.00 | NIST | |
| Tboil | 1139.13 | K | Joback Calculated Property |
| Tc | 1400.38 | K | Joback Calculated Property |
| Tfus | 679.98 | K | Joback Calculated Property |
| Vc | 1.597 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1404.35; 1460.42] | J/mol×K | [1139.13; 1400.38] |
|
| Cp,gas | 1404.35 | J/mol×K | 1139.13 | Joback Calculated Property |
| Cp,gas | 1417.94 | J/mol×K | 1182.67 | Joback Calculated Property |
| Cp,gas | 1429.68 | J/mol×K | 1226.21 | Joback Calculated Property |
| Cp,gas | 1439.68 | J/mol×K | 1269.76 | Joback Calculated Property |
| Cp,gas | 1448.07 | J/mol×K | 1313.30 | Joback Calculated Property |
| Cp,gas | 1454.94 | J/mol×K | 1356.84 | Joback Calculated Property |
| Cp,gas | 1460.42 | J/mol×K | 1400.38 | Joback Calculated Property |
| η | [0.0000109; 0.0001174] | Pa×s | [679.98; 1139.13] |
|
| η | 0.0001174 | Pa×s | 679.98 | Joback Calculated Property |
| η | 0.0000647 | Pa×s | 756.50 | Joback Calculated Property |
| η | 0.0000398 | Pa×s | 833.03 | Joback Calculated Property |
| η | 0.0000265 | Pa×s | 909.56 | Joback Calculated Property |
| η | 0.0000188 | Pa×s | 986.08 | Joback Calculated Property |
| η | 0.0000141 | Pa×s | 1062.61 | Joback Calculated Property |
| η | 0.0000109 | Pa×s | 1139.13 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Phthalic acid, 2-(3-chlorophenyl)ethyl tetradecyl ester.
Sources
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