- InChI
- InChI=1S/C13H14ClFO3/c1-3-13(4-2,11(14)16)12(17)18-10-8-6-5-7-9(10)15/h5-8H,3-4H2,1-2H3
- InChI Key
- IWJWOINZLRRWHE-UHFFFAOYSA-N
- Formula
- C13H14ClFO3
- SMILES
-
CCC(CC)(C(=O)Cl)C(=O)Oc1ccccc1
F - Molecular Weight1
- 272.70
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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° | -405.38 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -664.57 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 27.33 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 65.64 | kJ/mol | Joback Calculated Property |
| log10WS | -3.90 | Crippen Calculated Property | |
| logPoct/wat | 3.303 | Crippen Calculated Property | |
| McVol | 193.290 | ml/mol | McGowan Calculated Property |
| Pc | 2258.96 | kPa | Joback Calculated Property |
| Inp | 1641.00 | NIST | |
| Tboil | 692.13 | K | Joback Calculated Property |
| Tc | 908.25 | K | Joback Calculated Property |
| Tfus | 430.23 | K | Joback Calculated Property |
| Vc | 0.742 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [498.53; 562.88] | J/mol×K | [692.13; 908.25] | 
|
| Cp,gas | 498.53 | J/mol×K | 692.13 | Joback Calculated Property |
| Cp,gas | 511.46 | J/mol×K | 728.15 | Joback Calculated Property |
| Cp,gas | 523.45 | J/mol×K | 764.17 | Joback Calculated Property |
| Cp,gas | 534.55 | J/mol×K | 800.19 | Joback Calculated Property |
| Cp,gas | 544.79 | J/mol×K | 836.21 | Joback Calculated Property |
| Cp,gas | 554.21 | J/mol×K | 872.23 | Joback Calculated Property |
| Cp,gas | 562.88 | J/mol×K | 908.25 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, monochloride, 2-fluorophenyl ester.
Sources
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