- InChI
- InChI=1S/C14H23ClO4/c1-3-4-5-6-7-10-18-13(16)8-9-14(17)19-11-12(2)15/h8-9,12H,3-7,10-11H2,1-2H3/b9-8+
- InChI Key
- KFSJHJRXOISCGF-CMDGGOBGSA-N
- Formula
- C14H23ClO4
- SMILES
- CCCCCCCOC(=O)C=CC(=O)OCC(C)Cl
- Molecular Weight1
- 290.78
- 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° | -334.99 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -725.69 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 38.47 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 69.03 | kJ/mol | Joback Calculated Property |
| log10WS | -3.53 | Crippen Calculated Property | |
| logPoct/wat | 3.227 | Crippen Calculated Property | |
| McVol | 230.940 | ml/mol | McGowan Calculated Property |
| Pc | 1670.06 | kPa | Joback Calculated Property |
| Inp | [1973.00; 1973.00] |
|
|
| Inp | 1973.00 | NIST | |
| Inp | 1973.00 | NIST | |
| Tboil | 713.45 | K | Joback Calculated Property |
| Tc | 901.62 | K | Joback Calculated Property |
| Tfus | 401.70 | K | Joback Calculated Property |
| Vc | 0.890 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [629.92; 705.63] | J/mol×K | [713.45; 901.62] |
|
| Cp,gas | 629.92 | J/mol×K | 713.45 | Joback Calculated Property |
| Cp,gas | 644.45 | J/mol×K | 744.81 | Joback Calculated Property |
| Cp,gas | 658.19 | J/mol×K | 776.17 | Joback Calculated Property |
| Cp,gas | 671.17 | J/mol×K | 807.53 | Joback Calculated Property |
| Cp,gas | 683.39 | J/mol×K | 838.89 | Joback Calculated Property |
| Cp,gas | 694.87 | J/mol×K | 870.25 | Joback Calculated Property |
| Cp,gas | 705.63 | J/mol×K | 901.62 | Joback Calculated Property |
| η | [0.0000854; 0.0013688] | Pa×s | [401.70; 713.45] |
|
| η | 0.0013688 | Pa×s | 401.70 | Joback Calculated Property |
| η | 0.0006615 | Pa×s | 453.66 | Joback Calculated Property |
| η | 0.0003712 | Pa×s | 505.62 | Joback Calculated Property |
| η | 0.0002320 | Pa×s | 557.58 | Joback Calculated Property |
| η | 0.0001571 | Pa×s | 609.53 | Joback Calculated Property |
| η | 0.0001131 | Pa×s | 661.49 | Joback Calculated Property |
| η | 0.0000854 | Pa×s | 713.45 | Joback Calculated Property |
Similar Compounds
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Sources
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