- InChI
- InChI=1S/C16H19FO4/c1-2-3-4-7-12-20-15(18)10-11-16(19)21-14-9-6-5-8-13(14)17/h3-6,8-9H,2,7,10-12H2,1H3/b4-3+
- InChI Key
- DPAKKWMXDQIUMX-ONEGZZNKSA-N
- Formula
- C16H19FO4
- SMILES
- CCC=CCCOC(=O)CCC(=O)Oc1ccccc1F
- Molecular Weight1
- 294.32
- 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° | -395.81 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -717.00 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 39.70 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 71.60 | kJ/mol | Joback Calculated Property |
| log10WS | -4.18 | Crippen Calculated Property | |
| logPoct/wat | 3.411 | Crippen Calculated Property | |
| McVol | 224.890 | ml/mol | McGowan Calculated Property |
| Pc | 1827.85 | kPa | Joback Calculated Property |
| Inp | [2032.00; 2032.00] |
|
|
| Inp | 2032.00 | NIST | |
| Inp | 2032.00 | NIST | |
| Tboil | 753.15 | K | Joback Calculated Property |
| Tc | 954.26 | K | Joback Calculated Property |
| Tfus | 448.85 | K | Joback Calculated Property |
| Vc | 0.870 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [631.69; 702.73] | J/mol×K | [753.15; 954.26] |
|
| Cp,gas | 631.69 | J/mol×K | 753.15 | Joback Calculated Property |
| Cp,gas | 645.72 | J/mol×K | 786.67 | Joback Calculated Property |
| Cp,gas | 658.84 | J/mol×K | 820.19 | Joback Calculated Property |
| Cp,gas | 671.08 | J/mol×K | 853.71 | Joback Calculated Property |
| Cp,gas | 682.46 | J/mol×K | 887.22 | Joback Calculated Property |
| Cp,gas | 693.00 | J/mol×K | 920.74 | Joback Calculated Property |
| Cp,gas | 702.73 | J/mol×K | 954.26 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, 2-fluorophenyl trans-hex-3-en-1-yl ester.
Sources
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