- InChI
- InChI=1S/C18H19F17O2/c1-2-3-4-5-6-7-8-9-37-10(36)11(19,20)12(21,22)13(23,24)14(25,26)15(27,28)16(29,30)17(31,32)18(33,34)35/h2-9H2,1H3
- InChI Key
- ONIZYGSRFPNRPP-UHFFFAOYSA-N
- Formula
- C18H19F17O2
- SMILES
-
CCCCCCCCCOC(=O)C(F)(F)C(F)(F)C
(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F )(F)C(F)(F)F - Molecular Weight1
- 590.32
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.8936 | Relay (1.0) Calculated Property | |
| ΔfG° | -3422.29 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -4105.59 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 38.21 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 82.36 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.55 | eV | Relay (1.0) Calculated Property |
| log10WS | -9.26 | Relay (1.0) Calculated Property | |
| logPoct/wat | 8.290 | Crippen Calculated Property | |
| McVol | 302.010 | ml/mol | McGowan Calculated Property |
| Pc | 810.30 | kPa | Joback Calculated Property |
| Inp | 1407.00 | NIST | |
| Tboil | 539.59 | K | Relay (1.0) Calculated Property |
| Tc | 644.82 | K | Relay (1.0) Calculated Property |
| Tfus | 302.48 | K | Relay (1.0) Calculated Property |
| Vc | 1.212 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [940.93; 1016.87] | J/mol×K | [649.28; 795.29] | 
|
| Cp,gas | 940.93 | J/mol×K | 649.28 | Joback Calculated Property |
| Cp,gas | 955.85 | J/mol×K | 673.62 | Joback Calculated Property |
| Cp,gas | 969.77 | J/mol×K | 697.95 | Joback Calculated Property |
| Cp,gas | 982.76 | J/mol×K | 722.29 | Joback Calculated Property |
| Cp,gas | 994.90 | J/mol×K | 746.62 | Joback Calculated Property |
| Cp,gas | 1006.24 | J/mol×K | 770.96 | Joback Calculated Property |
| Cp,gas | 1016.87 | J/mol×K | 795.29 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Heptadecafluorononanoic acid, nonyl ester.
Sources
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