- InChI
- InChI=1S/C15H13ClO3/c16-13-8-4-5-9-14(13)18-10-11-19-15(17)12-6-2-1-3-7-12/h1-9H,10-11H2
- InChI Key
- WEVUWIBFSSKMIB-UHFFFAOYSA-N
- Formula
- C15H13ClO3
- SMILES
- O=C(OCCOc1ccccc1Cl)c1ccccc1
- Molecular Weight1
- 276.71
- 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° | -60.24 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -284.10 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 30.47 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 70.15 | kJ/mol | Joback Calculated Property |
| log10WS | -4.17 | Crippen Calculated Property | |
| logPoct/wat | 3.576 | Crippen Calculated Property | |
| McVol | 200.240 | ml/mol | McGowan Calculated Property |
| Pc | 2453.17 | kPa | Joback Calculated Property |
| Inp | [2225.00; 2225.00] |
|
|
| Inp | 2225.00 | NIST | |
| Inp | 2225.00 | NIST | |
| Tboil | 737.08 | K | Joback Calculated Property |
| Tc | 974.54 | K | Joback Calculated Property |
| Tfus | 448.48 | K | Joback Calculated Property |
| Vc | 0.750 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [516.53; 582.59] | J/mol×K | [737.08; 974.54] |
|
| Cp,gas | 516.53 | J/mol×K | 737.08 | Joback Calculated Property |
| Cp,gas | 530.35 | J/mol×K | 776.66 | Joback Calculated Property |
| Cp,gas | 543.00 | J/mol×K | 816.23 | Joback Calculated Property |
| Cp,gas | 554.52 | J/mol×K | 855.81 | Joback Calculated Property |
| Cp,gas | 564.94 | J/mol×K | 895.38 | Joback Calculated Property |
| Cp,gas | 574.28 | J/mol×K | 934.96 | Joback Calculated Property |
| Cp,gas | 582.59 | J/mol×K | 974.54 | Joback Calculated Property |
| η | [0.0000972; 0.0007901] | Pa×s | [448.48; 737.08] |
|
| η | 0.0007901 | Pa×s | 448.48 | Joback Calculated Property |
| η | 0.0004705 | Pa×s | 496.58 | Joback Calculated Property |
| η | 0.0003070 | Pa×s | 544.68 | Joback Calculated Property |
| η | 0.0002147 | Pa×s | 592.78 | Joback Calculated Property |
| η | 0.0001585 | Pa×s | 640.88 | Joback Calculated Property |
| η | 0.0001220 | Pa×s | 688.98 | Joback Calculated Property |
| η | 0.0000972 | Pa×s | 737.08 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzoic acid, 2-(2-chlorophenoxy)ethyl ester.
Sources
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