- InChI
- InChI=1S/C7H12Cl2O2/c1-4(2)5(3)11-7(10)6(8)9/h4-6H,1-3H3
- InChI Key
- VVJYTELLIBXTPJ-UHFFFAOYSA-N
- Formula
- C7H12Cl2O2
- SMILES
- CC(C)C(C)OC(=O)C(Cl)Cl
- Molecular Weight1
- 199.07
- 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.
- I : 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° | -257.04 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -479.93 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 14.50 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 47.94 | kJ/mol | Joback Calculated Property |
| log10WS | -2.40 | Crippen Calculated Property | |
| logPoct/wat | 2.378 | Crippen Calculated Property | |
| McVol | 141.410 | ml/mol | McGowan Calculated Property |
| Pc | 2787.66 | kPa | Joback Calculated Property |
| Inp | [1084.00; 1084.00] |
|
|
| Inp | 1084.00 | NIST | |
| Inp | 1084.00 | NIST | |
| I | [1476.00; 1476.00] |
|
|
| I | 1476.00 | NIST | |
| I | 1476.00 | NIST | |
| Tboil | 509.39 | K | Joback Calculated Property |
| Tc | 710.00 | K | Joback Calculated Property |
| Tfus | 255.65 | K | Joback Calculated Property |
| Vc | 0.531 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [291.53; 351.35] | J/mol×K | [509.39; 710.00] |
|
| Cp,gas | 291.53 | J/mol×K | 509.39 | Joback Calculated Property |
| Cp,gas | 302.81 | J/mol×K | 542.82 | Joback Calculated Property |
| Cp,gas | 313.56 | J/mol×K | 576.26 | Joback Calculated Property |
| Cp,gas | 323.78 | J/mol×K | 609.69 | Joback Calculated Property |
| Cp,gas | 333.48 | J/mol×K | 643.13 | Joback Calculated Property |
| Cp,gas | 342.67 | J/mol×K | 676.56 | Joback Calculated Property |
| Cp,gas | 351.35 | J/mol×K | 710.00 | Joback Calculated Property |
| η | [0.0002372; 0.0078195] | Pa×s | [255.65; 509.39] |
|
| η | 0.0078195 | Pa×s | 255.65 | Joback Calculated Property |
| η | 0.0028881 | Pa×s | 297.94 | Joback Calculated Property |
| η | 0.0013664 | Pa×s | 340.23 | Joback Calculated Property |
| η | 0.0007628 | Pa×s | 382.52 | Joback Calculated Property |
| η | 0.0004782 | Pa×s | 424.81 | Joback Calculated Property |
| η | 0.0003263 | Pa×s | 467.10 | Joback Calculated Property |
| η | 0.0002372 | Pa×s | 509.39 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Acetic acid, dichloro, 1,2-dimethylpropyl ester.
Sources
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