- InChI
- InChI=1S/C7H6F5NO3/c8-6(9,7(10,11)12)5(15)13-3-1-2-16-4(3)14/h3H,1-2H2,(H,13,15)
- InChI Key
- RNSQINXUQVPRPY-UHFFFAOYSA-N
- Formula
- C7H6F5NO3
- SMILES
- O=C1OCCC1NC(=O)C(F)(F)C(F)(F)F
- Molecular Weight1
- 247.12
- 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 | 0.4762 | Relay (1.0) Calculated Property | |
| ΔfG° | -1172.00 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1577.76 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 22.58 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 65.29 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.35 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.22 | Relay (1.0) Calculated Property | |
| logPoct/wat | 0.616 | Crippen Calculated Property | |
| McVol | 126.470 | ml/mol | McGowan Calculated Property |
| Pc | 3103.64 | kPa | Joback Calculated Property |
| Inp | 1186.00 | NIST | |
| Tboil | 478.09 | K | Relay (1.0) Calculated Property |
| Tc | 648.16 | K | Relay (1.0) Calculated Property |
| Tfus | 363.83 | K | Relay (1.0) Calculated Property |
| Vc | 0.470 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [346.84; 406.20] | J/mol×K | [563.54; 760.72] | 
|
| Cp,gas | 346.84 | J/mol×K | 563.54 | Joback Calculated Property |
| Cp,gas | 358.72 | J/mol×K | 596.40 | Joback Calculated Property |
| Cp,gas | 369.77 | J/mol×K | 629.27 | Joback Calculated Property |
| Cp,gas | 380.00 | J/mol×K | 662.13 | Joback Calculated Property |
| Cp,gas | 389.46 | J/mol×K | 694.99 | Joback Calculated Property |
| Cp,gas | 398.18 | J/mol×K | 727.86 | Joback Calculated Property |
| Cp,gas | 406.20 | J/mol×K | 760.72 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to L-Homoserine lactone, N-pentafluoropropionyl-.
Sources
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