- InChI
- InChI=1S/C19H27ClO4/c1-3-4-5-6-7-8-12-23-18(21)16-10-9-11-17(13-16)19(22)24-14-15(2)20/h9-11,13,15H,3-8,12,14H2,1-2H3
- InChI Key
- UEPRZLTVNDRCJD-UHFFFAOYSA-N
- Formula
- C19H27ClO4
- SMILES
-
CCCCCCCCOC(=O)c1cccc(C(=O)OCC(
C)Cl)c1 - Molecular Weight1
- 354.87
- 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° | -270.33 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -721.05 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 44.87 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 83.14 | kJ/mol | Joback Calculated Property |
| log10WS | -5.99 | Crippen Calculated Property | |
| logPoct/wat | 4.988 | Crippen Calculated Property | |
| McVol | 281.930 | ml/mol | McGowan Calculated Property |
| Pc | 1410.13 | kPa | Joback Calculated Property |
| Inp | 2542.00 | NIST | |
| Tboil | 855.35 | K | Joback Calculated Property |
| Tc | 1061.57 | K | Joback Calculated Property |
| Tfus | 502.07 | K | Joback Calculated Property |
| Vc | 1.083 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [846.82; 919.45] | J/mol×K | [855.35; 1061.57] | 
|
| Cp,gas | 846.82 | J/mol×K | 855.35 | Joback Calculated Property |
| Cp,gas | 861.69 | J/mol×K | 889.72 | Joback Calculated Property |
| Cp,gas | 875.42 | J/mol×K | 924.09 | Joback Calculated Property |
| Cp,gas | 888.04 | J/mol×K | 958.46 | Joback Calculated Property |
| Cp,gas | 899.57 | J/mol×K | 992.83 | Joback Calculated Property |
| Cp,gas | 910.03 | J/mol×K | 1027.20 | Joback Calculated Property |
| Cp,gas | 919.45 | J/mol×K | 1061.57 | Joback Calculated Property |
| η | [0.0000500; 0.0006030] | Pa×s | [502.07; 855.35] |
|
| η | 0.0006030 | Pa×s | 502.07 | Joback Calculated Property |
| η | 0.0003202 | Pa×s | 560.95 | Joback Calculated Property |
| η | 0.0001918 | Pa×s | 619.83 | Joback Calculated Property |
| η | 0.0001256 | Pa×s | 678.71 | Joback Calculated Property |
| η | 0.0000879 | Pa×s | 737.59 | Joback Calculated Property |
| η | 0.0000649 | Pa×s | 796.47 | Joback Calculated Property |
| η | 0.0000500 | Pa×s | 855.35 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Isophthalic acid, 2-chloropropyl octyl ester.
Sources
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