- InChI
- InChI=1S/C8H14Cl2O2/c1-6(2)4-7(11)12-8(3,10)5-9/h6H,4-5H2,1-3H3
- InChI Key
- HOYDHGBXJGTXGW-UHFFFAOYSA-N
- Formula
- C8H14Cl2O2
- SMILES
- CC(C)CC(=O)OC(C)(Cl)CCl
- Molecular Weight1
- 213.10
- 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° | -240.90 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -498.76 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 16.72 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 49.64 | kJ/mol | Joback Calculated Property |
| log10WS | -2.71 | Crippen Calculated Property | |
| logPoct/wat | 2.769 | Crippen Calculated Property | |
| McVol | 155.500 | ml/mol | McGowan Calculated Property |
| Pc | 2532.82 | kPa | Joback Calculated Property |
| Inp | [1252.00; 1252.00] |
|
|
| Inp | 1252.00 | NIST | |
| Inp | 1252.00 | NIST | |
| Tboil | 529.92 | K | Joback Calculated Property |
| Tc | 731.23 | K | Joback Calculated Property |
| Tfus | 299.34 | K | Joback Calculated Property |
| Vc | 0.589 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [338.15; 403.04] | J/mol×K | [529.92; 731.23] |
|
| Cp,gas | 338.15 | J/mol×K | 529.92 | Joback Calculated Property |
| Cp,gas | 350.64 | J/mol×K | 563.47 | Joback Calculated Property |
| Cp,gas | 362.43 | J/mol×K | 597.02 | Joback Calculated Property |
| Cp,gas | 373.54 | J/mol×K | 630.58 | Joback Calculated Property |
| Cp,gas | 383.99 | J/mol×K | 664.13 | Joback Calculated Property |
| Cp,gas | 393.82 | J/mol×K | 697.68 | Joback Calculated Property |
| Cp,gas | 403.04 | J/mol×K | 731.23 | Joback Calculated Property |
| η | [0.0002269; 0.0044860] | Pa×s | [299.34; 529.92] |
|
| η | 0.0044860 | Pa×s | 299.34 | Joback Calculated Property |
| η | 0.0020557 | Pa×s | 337.77 | Joback Calculated Property |
| η | 0.0011049 | Pa×s | 376.20 | Joback Calculated Property |
| η | 0.0006663 | Pa×s | 414.63 | Joback Calculated Property |
| η | 0.0004378 | Pa×s | 453.06 | Joback Calculated Property |
| η | 0.0003072 | Pa×s | 491.49 | Joback Calculated Property |
| η | 0.0002269 | Pa×s | 529.92 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,3-Dichloroisopropyl isopentanoate.
Sources
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