- InChI
- InChI=1S/C13H23FO4/c1-3-4-5-6-11(2)18-13(16)8-7-12(15)17-10-9-14/h11H,3-10H2,1-2H3
- InChI Key
- ABIINXBGFGNUNB-UHFFFAOYSA-N
- Formula
- C13H23FO4
- SMILES
- CCCCCC(C)OC(=O)CCC(=O)OCCF
- Molecular Weight1
- 262.32
- 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° | -606.51 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1002.64 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 34.56 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 61.64 | kJ/mol | Joback Calculated Property |
| log10WS | -2.95 | Crippen Calculated Property | |
| logPoct/wat | 2.791 | Crippen Calculated Property | |
| McVol | 210.680 | ml/mol | McGowan Calculated Property |
| Pc | 1720.31 | kPa | Joback Calculated Property |
| Inp | [1684.00; 1684.00] |
|
|
| Inp | 1684.00 | NIST | |
| Inp | 1684.00 | NIST | |
| Tboil | 648.25 | K | Joback Calculated Property |
| Tc | 821.35 | K | Joback Calculated Property |
| Tfus | 366.18 | K | Joback Calculated Property |
| Vc | 0.824 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [576.79; 655.77] | J/mol×K | [648.25; 821.35] |
|
| Cp,gas | 576.79 | J/mol×K | 648.25 | Joback Calculated Property |
| Cp,gas | 591.62 | J/mol×K | 677.10 | Joback Calculated Property |
| Cp,gas | 605.77 | J/mol×K | 705.95 | Joback Calculated Property |
| Cp,gas | 619.26 | J/mol×K | 734.80 | Joback Calculated Property |
| Cp,gas | 632.09 | J/mol×K | 763.65 | Joback Calculated Property |
| Cp,gas | 644.26 | J/mol×K | 792.50 | Joback Calculated Property |
| Cp,gas | 655.77 | J/mol×K | 821.35 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, hept-2-yl 2-fluoroethyl ester.
Sources
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