- InChI
- InChI=1S/C10H9ClO4/c1-7(12)14-6-10(13)15-9-4-2-8(11)3-5-9/h2-5H,6H2,1H3
- InChI Key
- XDEZQKYHBPNTOE-UHFFFAOYSA-N
- Formula
- C10H9ClO4
- SMILES
- CC(=O)OCC(=O)Oc1ccc(Cl)cc1
- Molecular Weight1
- 228.63
- 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° | -343.67 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -530.01 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 25.08 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 63.49 | kJ/mol | Joback Calculated Property |
| log10WS | -2.17 | Crippen Calculated Property | |
| logPoct/wat | 1.808 | Crippen Calculated Property | |
| McVol | 155.120 | ml/mol | McGowan Calculated Property |
| Pc | 3062.55 | kPa | Joback Calculated Property |
| Inp | 1553.00 | NIST | |
| Tboil | 649.87 | K | Joback Calculated Property |
| Tc | 872.33 | K | Joback Calculated Property |
| Tfus | 415.64 | K | Joback Calculated Property |
| Vc | 0.585 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [362.16; 417.40] | J/mol×K | [649.87; 872.33] | 
|
| Cp,gas | 362.16 | J/mol×K | 649.87 | Joback Calculated Property |
| Cp,gas | 373.21 | J/mol×K | 686.95 | Joback Calculated Property |
| Cp,gas | 383.52 | J/mol×K | 724.02 | Joback Calculated Property |
| Cp,gas | 393.11 | J/mol×K | 761.10 | Joback Calculated Property |
| Cp,gas | 401.95 | J/mol×K | 798.18 | Joback Calculated Property |
| Cp,gas | 410.05 | J/mol×K | 835.25 | Joback Calculated Property |
| Cp,gas | 417.40 | J/mol×K | 872.33 | Joback Calculated Property |
| η | [0.0001731; 0.0011091] | Pa×s | [415.64; 649.87] |
|
| η | 0.0011091 | Pa×s | 415.64 | Joback Calculated Property |
| η | 0.0007125 | Pa×s | 454.68 | Joback Calculated Property |
| η | 0.0004909 | Pa×s | 493.72 | Joback Calculated Property |
| η | 0.0003572 | Pa×s | 532.75 | Joback Calculated Property |
| η | 0.0002715 | Pa×s | 571.79 | Joback Calculated Property |
| η | 0.0002137 | Pa×s | 610.83 | Joback Calculated Property |
| η | 0.0001731 | Pa×s | 649.87 | Joback Calculated Property |
Similar Compounds
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Sources
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