- InChI
- InChI=1S/C8H12F5NO/c1-2-3-4-5-14-6(15)7(9,10)8(11,12)13/h2-5H2,1H3,(H,14,15)
- InChI Key
- ZDTRGNGXDFYEBK-UHFFFAOYSA-N
- Formula
- C8H12F5NO
- SMILES
- CCCCCNC(=O)C(F)(F)C(F)(F)F
- Molecular Weight1
- 233.18
- 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 | 0.5179 | Relay (1.0) Calculated Property | |
| ΔfG° | -991.42 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1366.34 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 23.75 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 51.82 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.12 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.84 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.490 | Crippen Calculated Property | |
| McVol | 143.980 | ml/mol | McGowan Calculated Property |
| Pc | 2274.07 | kPa | Joback Calculated Property |
| Inp | [983.00; 983.00] |
|
|
| Inp | 983.00 | NIST | |
| Inp | 983.00 | NIST | |
| Tboil | 424.79 | K | Relay (1.0) Calculated Property |
| Tc | 559.93 | K | Relay (1.0) Calculated Property |
| Tfus | 261.46 | K | Relay (1.0) Calculated Property |
| Vc | 0.527 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [349.14; 412.21] | J/mol×K | [476.37; 634.26] |
|
| Cp,gas | 349.14 | J/mol×K | 476.37 | Joback Calculated Property |
| Cp,gas | 361.22 | J/mol×K | 502.68 | Joback Calculated Property |
| Cp,gas | 372.63 | J/mol×K | 529.00 | Joback Calculated Property |
| Cp,gas | 383.41 | J/mol×K | 555.31 | Joback Calculated Property |
| Cp,gas | 393.58 | J/mol×K | 581.63 | Joback Calculated Property |
| Cp,gas | 403.17 | J/mol×K | 607.94 | Joback Calculated Property |
| Cp,gas | 412.21 | J/mol×K | 634.26 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Pentafluoropropanamide, N-pentyl-.
Sources
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