- InChI
- InChI=1S/C20H21ClO5/c1-2-3-12-25-19(22)15-8-4-5-9-16(15)20(23)26-14-13-24-18-11-7-6-10-17(18)21/h4-11H,2-3,12-14H2,1H3
- InChI Key
- RYLKTLAWYMWOQE-UHFFFAOYSA-N
- Formula
- C20H21ClO5
- SMILES
-
CCCCOC(=O)c1ccccc1C(=O)OCCOc1c
cccc1Cl - Molecular Weight1
- 376.83
- 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° | -261.69 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -643.57 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 45.82 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 91.10 | kJ/mol | Joback Calculated Property |
| log10WS | -5.67 | Crippen Calculated Property | |
| logPoct/wat | 4.533 | Crippen Calculated Property | |
| McVol | 278.130 | ml/mol | McGowan Calculated Property |
| Pc | 1641.76 | kPa | Joback Calculated Property |
| Inp | [2781.00; 2781.00] |
|
|
| Inp | 2781.00 | NIST | |
| Inp | 2781.00 | NIST | |
| Tboil | 932.75 | K | Joback Calculated Property |
| Tc | 1160.48 | K | Joback Calculated Property |
| Tfus | 589.51 | K | Joback Calculated Property |
| Vc | 1.054 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [829.70; 880.52] | J/mol×K | [932.75; 1160.48] |
|
| Cp,gas | 829.70 | J/mol×K | 932.75 | Joback Calculated Property |
| Cp,gas | 841.60 | J/mol×K | 970.70 | Joback Calculated Property |
| Cp,gas | 852.10 | J/mol×K | 1008.66 | Joback Calculated Property |
| Cp,gas | 861.22 | J/mol×K | 1046.61 | Joback Calculated Property |
| Cp,gas | 868.99 | J/mol×K | 1084.57 | Joback Calculated Property |
| Cp,gas | 875.42 | J/mol×K | 1122.52 | Joback Calculated Property |
| Cp,gas | 880.52 | J/mol×K | 1160.48 | Joback Calculated Property |
| η | [0.0000369; 0.0002702] | Pa×s | [589.51; 932.75] |
|
| η | 0.0002702 | Pa×s | 589.51 | Joback Calculated Property |
| η | 0.0001675 | Pa×s | 646.72 | Joback Calculated Property |
| η | 0.0001122 | Pa×s | 703.92 | Joback Calculated Property |
| η | 0.0000798 | Pa×s | 761.13 | Joback Calculated Property |
| η | 0.0000596 | Pa×s | 818.34 | Joback Calculated Property |
| η | 0.0000462 | Pa×s | 875.54 | Joback Calculated Property |
| η | 0.0000369 | Pa×s | 932.75 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Phthalic acid, butyl 2-(4-chlorophenoxy)ethyl ester.
Sources
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