- InChI
- InChI=1S/C12H11ClFNO6/c13-5-6-20-11(16)3-4-12(17)21-10-7-8(14)1-2-9(10)15(18)19/h1-2,7H,3-6H2
- InChI Key
- RXQRLUKPKMZUBT-UHFFFAOYSA-N
- Formula
- C12H11ClFNO6
- SMILES
-
O=C(CCC(=O)Oc1cc(F)ccc1[N+](=O
)[O-])OCCCl - Molecular Weight1
- 319.67
- 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° | -495.72 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -789.63 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 44.31 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 84.38 | kJ/mol | Joback Calculated Property |
| log10WS | -3.46 | Crippen Calculated Property | |
| logPoct/wat | 2.202 | Crippen Calculated Property | |
| McVol | 202.490 | ml/mol | McGowan Calculated Property |
| Pc | 2386.52 | kPa | Joback Calculated Property |
| Inp | 2244.00 | NIST | |
| Tboil | 851.72 | K | Joback Calculated Property |
| Tc | 1078.47 | K | Joback Calculated Property |
| Tfus | 594.90 | K | Joback Calculated Property |
| Vc | 0.796 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [559.23; 600.87] | J/mol×K | [851.72; 1078.47] | 
|
| Cp,gas | 559.23 | J/mol×K | 851.72 | Joback Calculated Property |
| Cp,gas | 568.61 | J/mol×K | 889.51 | Joback Calculated Property |
| Cp,gas | 577.01 | J/mol×K | 927.30 | Joback Calculated Property |
| Cp,gas | 584.44 | J/mol×K | 965.10 | Joback Calculated Property |
| Cp,gas | 590.88 | J/mol×K | 1002.89 | Joback Calculated Property |
| Cp,gas | 596.36 | J/mol×K | 1040.68 | Joback Calculated Property |
| Cp,gas | 600.87 | J/mol×K | 1078.47 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, 5-fluoro-2-nitrophenyl 2-chloroethyl ester.
Sources
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