- InChI
- InChI=1S/C8H6Cl2O2/c9-7-1-2-8(10)6(3-7)4-12-5-11/h1-3,5H,4H2
- InChI Key
- HDJCBTIXLGNCTG-UHFFFAOYSA-N
- Formula
- C8H6Cl2O2
- SMILES
- O=COCc1cc(Cl)ccc1Cl
- Molecular Weight1
- 205.04
- 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° | -118.75 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -244.14 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 21.61 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 54.90 | kJ/mol | Joback Calculated Property |
| log10WS | -3.00 | Crippen Calculated Property | |
| logPoct/wat | 2.666 | Crippen Calculated Property | |
| McVol | 131.740 | ml/mol | McGowan Calculated Property |
| Pc | 3452.08 | kPa | Joback Calculated Property |
| Inp | [1450.00; 1450.00] |
|
|
| Inp | 1450.00 | NIST | |
| Inp | 1450.00 | NIST | |
| Tboil | 565.02 | K | Joback Calculated Property |
| Tc | 791.18 | K | Joback Calculated Property |
| Tfus | 355.45 | K | Joback Calculated Property |
| Vc | 0.508 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [260.21; 306.80] | J/mol×K | [565.02; 791.18] |
|
| Cp,gas | 260.21 | J/mol×K | 565.02 | Joback Calculated Property |
| Cp,gas | 269.33 | J/mol×K | 602.71 | Joback Calculated Property |
| Cp,gas | 277.90 | J/mol×K | 640.41 | Joback Calculated Property |
| Cp,gas | 285.92 | J/mol×K | 678.10 | Joback Calculated Property |
| Cp,gas | 293.41 | J/mol×K | 715.79 | Joback Calculated Property |
| Cp,gas | 300.37 | J/mol×K | 753.49 | Joback Calculated Property |
| Cp,gas | 306.80 | J/mol×K | 791.18 | Joback Calculated Property |
| η | [0.0002610; 0.0014631] | Pa×s | [355.45; 565.02] |
|
| η | 0.0014631 | Pa×s | 355.45 | Joback Calculated Property |
| η | 0.0009653 | Pa×s | 390.38 | Joback Calculated Property |
| η | 0.0006819 | Pa×s | 425.31 | Joback Calculated Property |
| η | 0.0005078 | Pa×s | 460.24 | Joback Calculated Property |
| η | 0.0003942 | Pa×s | 495.16 | Joback Calculated Property |
| η | 0.0003164 | Pa×s | 530.09 | Joback Calculated Property |
| η | 0.0002610 | Pa×s | 565.02 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Formic acid, (2,5-dichlorophenyl)methyl ester.
Sources
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