- InChI
- InChI=1S/C12H12ClFO5/c1-2-18-10(15)6-17-7-11(16)19-12-8(13)4-3-5-9(12)14/h3-5H,2,6-7H2,1H3
- InChI Key
- LENPPBDOXUEACY-UHFFFAOYSA-N
- Formula
- C12H12ClFO5
- SMILES
- CCOC(=O)COCC(=O)Oc1c(F)cccc1Cl
- Molecular Weight1
- 290.67
- 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° | -636.27 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -911.09 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 34.14 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 70.20 | kJ/mol | Joback Calculated Property |
| log10WS | -2.43 | Crippen Calculated Property | |
| logPoct/wat | 1.964 | Crippen Calculated Property | |
| McVol | 190.940 | ml/mol | McGowan Calculated Property |
| Pc | 2320.31 | kPa | Joback Calculated Property |
| Inp | 2254.00 | NIST | |
| Tboil | 722.30 | K | Joback Calculated Property |
| Tc | 928.03 | K | Joback Calculated Property |
| Tfus | 473.52 | K | Joback Calculated Property |
| Vc | 0.733 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [492.88; 549.83] | J/mol×K | [722.30; 928.03] | 
|
| Cp,gas | 492.88 | J/mol×K | 722.30 | Joback Calculated Property |
| Cp,gas | 504.36 | J/mol×K | 756.59 | Joback Calculated Property |
| Cp,gas | 515.06 | J/mol×K | 790.88 | Joback Calculated Property |
| Cp,gas | 524.98 | J/mol×K | 825.17 | Joback Calculated Property |
| Cp,gas | 534.09 | J/mol×K | 859.46 | Joback Calculated Property |
| Cp,gas | 542.37 | J/mol×K | 893.75 | Joback Calculated Property |
| Cp,gas | 549.83 | J/mol×K | 928.03 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diglycolic acid, 2-chloro-6-fluorophenyl ethyl ester.
Sources
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