- InChI
- InChI=1S/C23H39F7O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-32-20(31)21(24,25)22(26,27)23(28,29)30/h2-19H2,1H3
- InChI Key
- NJWZHUGJBXGPMH-UHFFFAOYSA-N
- Formula
- C23H39F7O2
- SMILES
-
CCCCCCCCCCCCCCCCCCCOC(=O)C(F)(
F)C(F)(F)C(F)(F)F - Molecular Weight1
- 480.54
- Other Names
-
- Nonadecyl 2,2,3,3,4,4,4-heptafluorobutanoate
- 1-Nonadecanol, heptafluorobutyrate
- Nonadecyl perfluorobutyrate
- 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° | -1446.29 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -2161.87 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 57.43 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 66.34 | kJ/mol | Joback Calculated Property |
| log10WS | -9.60 | Crippen Calculated Property | |
| logPoct/wat | 9.014 | Crippen Calculated Property | |
| McVol | 354.760 | ml/mol | McGowan Calculated Property |
| Pc | 755.57 | kPa | Joback Calculated Property |
| Inp | [2126.50; 2126.50] |
|
|
| Inp | 2126.50 | NIST | |
| Inp | 2126.50 | NIST | |
| Tboil | 787.13 | K | Joback Calculated Property |
| Tc | 964.37 | K | Joback Calculated Property |
| Tfus | 432.52 | K | Joback Calculated Property |
| Vc | 1.440 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1147.87; 1250.37] | J/mol×K | [787.13; 964.37] |
|
| Cp,gas | 1147.87 | J/mol×K | 787.13 | Joback Calculated Property |
| Cp,gas | 1167.41 | J/mol×K | 816.67 | Joback Calculated Property |
| Cp,gas | 1185.88 | J/mol×K | 846.21 | Joback Calculated Property |
| Cp,gas | 1203.33 | J/mol×K | 875.75 | Joback Calculated Property |
| Cp,gas | 1219.86 | J/mol×K | 905.29 | Joback Calculated Property |
| Cp,gas | 1235.51 | J/mol×K | 934.83 | Joback Calculated Property |
| Cp,gas | 1250.37 | J/mol×K | 964.37 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Nonadecyl heptafluorobutyrate.
Sources
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