- InChI
- InChI=1S/C10H8Cl2O2/c11-6-3-7-14-10(13)8-4-1-2-5-9(8)12/h1-6H,7H2/b6-3+
- InChI Key
- GIMRXOTXLJWYLM-ZZXKWVIFSA-N
- Formula
- C10H8Cl2O2
- SMILES
- O=C(OCC=CCl)c1ccccc1Cl
- Molecular Weight1
- 231.07
- 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° | -41.46 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -183.73 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 26.69 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 58.68 | kJ/mol | Joback Calculated Property |
| log10WS | -3.74 | Crippen Calculated Property | |
| logPoct/wat | 3.249 | Crippen Calculated Property | |
| McVol | 155.620 | ml/mol | McGowan Calculated Property |
| Pc | 2960.12 | kPa | Joback Calculated Property |
| Inp | [1617.00; 1617.00] |
|
|
| Inp | 1617.00 | NIST | |
| Inp | 1617.00 | NIST | |
| Tboil | 615.17 | K | Joback Calculated Property |
| Tc | 846.82 | K | Joback Calculated Property |
| Tfus | 368.32 | K | Joback Calculated Property |
| Vc | 0.590 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [329.06; 383.47] | J/mol×K | [615.17; 846.82] |
|
| Cp,gas | 329.06 | J/mol×K | 615.17 | Joback Calculated Property |
| Cp,gas | 339.96 | J/mol×K | 653.78 | Joback Calculated Property |
| Cp,gas | 350.08 | J/mol×K | 692.39 | Joback Calculated Property |
| Cp,gas | 359.46 | J/mol×K | 731.00 | Joback Calculated Property |
| Cp,gas | 368.12 | J/mol×K | 769.60 | Joback Calculated Property |
| Cp,gas | 376.11 | J/mol×K | 808.21 | Joback Calculated Property |
| Cp,gas | 383.47 | J/mol×K | 846.82 | Joback Calculated Property |
| η | [0.0001722; 0.0013966] | Pa×s | [368.32; 615.17] |
|
| η | 0.0013966 | Pa×s | 368.32 | Joback Calculated Property |
| η | 0.0008269 | Pa×s | 409.46 | Joback Calculated Property |
| η | 0.0005387 | Pa×s | 450.60 | Joback Calculated Property |
| η | 0.0003771 | Pa×s | 491.75 | Joback Calculated Property |
| η | 0.0002789 | Pa×s | 532.89 | Joback Calculated Property |
| η | 0.0002154 | Pa×s | 574.03 | Joback Calculated Property |
| η | 0.0001722 | Pa×s | 615.17 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Chlorobenzoic acid, 3-chloroprop-2-enyl ester.
Sources
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