- InChI
- InChI=1S/C26H41FO4/c1-2-3-4-5-6-9-12-17-22-30-25(28)20-13-10-7-8-11-14-21-26(29)31-24-19-16-15-18-23(24)27/h15-16,18-19H,2-14,17,20-22H2,1H3
- InChI Key
- QYENDWGXCVTGMF-UHFFFAOYSA-N
- Formula
- C26H41FO4
- SMILES
-
CCCCCCCCCCOC(=O)CCCCCCCCC(=O)O
c1ccccc1F - Molecular Weight1
- 436.60
- 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° | -391.83 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1040.62 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 65.40 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 93.90 | kJ/mol | Joback Calculated Property |
| log10WS | -8.51 | Crippen Calculated Property | |
| logPoct/wat | 7.536 | Crippen Calculated Property | |
| McVol | 370.090 | ml/mol | McGowan Calculated Property |
| Pc | 890.54 | kPa | Joback Calculated Property |
| Inp | [3109.00; 3109.00] |
|
|
| Inp | 3109.00 | NIST | |
| Inp | 3109.00 | NIST | |
| Tboil | 977.79 | K | Joback Calculated Property |
| Tc | 1198.89 | K | Joback Calculated Property |
| Tfus | 566.63 | K | Joback Calculated Property |
| Vc | 1.450 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1250.48; 1333.39] | J/mol×K | [977.79; 1198.89] |
|
| Cp,gas | 1250.48 | J/mol×K | 977.79 | Joback Calculated Property |
| Cp,gas | 1268.01 | J/mol×K | 1014.64 | Joback Calculated Property |
| Cp,gas | 1283.99 | J/mol×K | 1051.49 | Joback Calculated Property |
| Cp,gas | 1298.47 | J/mol×K | 1088.34 | Joback Calculated Property |
| Cp,gas | 1311.49 | J/mol×K | 1125.19 | Joback Calculated Property |
| Cp,gas | 1323.11 | J/mol×K | 1162.04 | Joback Calculated Property |
| Cp,gas | 1333.39 | J/mol×K | 1198.89 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Sebacic acid, decyl 2-fluorophenyl ester.
Sources
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