- InChI
- InChI=1S/C10H3F17O2/c1-29-2(28)3(11,12)4(13,14)5(15,16)6(17,18)7(19,20)8(21,22)9(23,24)10(25,26)27/h1H3
- InChI Key
- CFNCFMKWDPDIPT-UHFFFAOYSA-N
- Formula
- C10H3F17O2
- SMILES
-
COC(=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
- 478.10
- 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 | 0.5997 | Relay (1.0) Calculated Property | |
| ΔfG° | -3489.65 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -3919.18 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 17.49 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 64.45 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 11.12 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.06 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.169 | Crippen Calculated Property | |
| McVol | 189.290 | ml/mol | McGowan Calculated Property |
| Pc | 1327.14 | kPa | Joback Calculated Property |
| Inp | [760.50; 760.50] |
|
|
| Inp | 760.50 | NIST | |
| Inp | 760.50 | NIST | |
| Tboil | 440.79 | K | Relay (1.0) Calculated Property |
| Tc | 576.98 | K | Relay (1.0) Calculated Property |
| Tfus | 297.21 | K | Relay (1.0) Calculated Property |
| Vc | 0.807 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [527.50; 591.64] | J/mol×K | [466.24; 592.08] |
|
| Cp,gas | 527.50 | J/mol×K | 466.24 | Joback Calculated Property |
| Cp,gas | 540.26 | J/mol×K | 487.21 | Joback Calculated Property |
| Cp,gas | 552.13 | J/mol×K | 508.19 | Joback Calculated Property |
| Cp,gas | 563.17 | J/mol×K | 529.16 | Joback Calculated Property |
| Cp,gas | 573.41 | J/mol×K | 550.13 | Joback Calculated Property |
| Cp,gas | 582.88 | J/mol×K | 571.11 | Joback Calculated Property |
| Cp,gas | 591.64 | J/mol×K | 592.08 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Heptadecafluorononanoic acid, methyl ester.
Sources
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