- InChI
- InChI=1S/C13H23ClO4/c1-2-17-12(15)11-13(16)18-10-8-6-4-3-5-7-9-14/h2-11H2,1H3
- InChI Key
- QVPHPCBYJIWUMA-UHFFFAOYSA-N
- Formula
- C13H23ClO4
- SMILES
- CCOC(=O)CC(=O)OCCCCCCCCCl
- Molecular Weight1
- 278.77
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.8205 | Relay (1.0) Calculated Property | |
| ΔfG° | -574.09 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -974.32 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 42.36 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 94.55 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.91 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.85 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.062 | Crippen Calculated Property | |
| McVol | 221.150 | ml/mol | McGowan Calculated Property |
| Pc | 1609.00 | kPa | Joback Calculated Property |
| Inp | [1934.00; 1934.00] |
|
|
| Inp | 1934.00 | NIST | |
| Inp | 1934.00 | NIST | |
| Tboil | 571.61 | K | Relay (1.0) Calculated Property |
| Tc | 763.78 | K | Relay (1.0) Calculated Property |
| Tfus | 241.75 | K | Relay (1.0) Calculated Property |
| Vc | 0.837 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [586.76; 664.02] | J/mol×K | [650.91; 827.10] |
|
| Cp,gas | 586.76 | J/mol×K | 650.91 | Joback Calculated Property |
| Cp,gas | 601.50 | J/mol×K | 680.27 | Joback Calculated Property |
| Cp,gas | 615.49 | J/mol×K | 709.64 | Joback Calculated Property |
| Cp,gas | 628.72 | J/mol×K | 739.00 | Joback Calculated Property |
| Cp,gas | 641.22 | J/mol×K | 768.37 | Joback Calculated Property |
| Cp,gas | 652.98 | J/mol×K | 797.73 | Joback Calculated Property |
| Cp,gas | 664.02 | J/mol×K | 827.10 | Joback Calculated Property |
| η | [0.0001002; 0.0026242] | Pa×s | [350.85; 650.91] |
|
| η | 0.0026242 | Pa×s | 350.85 | Joback Calculated Property |
| η | 0.0010844 | Pa×s | 400.86 | Joback Calculated Property |
| η | 0.0005452 | Pa×s | 450.87 | Joback Calculated Property |
| η | 0.0003144 | Pa×s | 500.88 | Joback Calculated Property |
| η | 0.0002004 | Pa×s | 550.89 | Joback Calculated Property |
| η | 0.0001377 | Pa×s | 600.90 | Joback Calculated Property |
| η | 0.0001002 | Pa×s | 650.91 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Malonic acid, 8-chlorooctyl ethyl ester.
Sources
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