- InChI
- InChI=1S/C16H15Cl3F5NO4/c1-2-3-8-28-12(15(17,18)19)25-11(26)9-6-4-5-7-10(9)29-13(27)14(20,21)16(22,23)24/h4-7,12H,2-3,8H2,1H3,(H,25,26)
- InChI Key
- GHRNNYVDPNBINL-UHFFFAOYSA-N
- Formula
- C16H15Cl3F5NO4
- SMILES
-
CCCCOC(NC(=O)c1ccccc1OC(=O)C(F
)(F)C(F)(F)F)C(Cl)(Cl)Cl - Molecular Weight1
- 486.65
- 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 | 0.8040 | Relay (... Calculated Property | |
| ΔfG° | -1195.59 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1782.48 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 43.75 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 97.03 | kJ/mol | Relay (... Calculated Property |
| IE | 9.56 | eV | Relay (... Calculated Property |
| log10WS | -6.35 | Relay (... Calculated Property | |
| logPoct/wat | 5.032 | Crippen Calculated Property | |
| McVol | 282.970 | ml/mol | McGowan Calculated Property |
| Pc | 1474.75 | kPa | Joback Calculated Property |
| Inp | 2092.00 | NIST | |
| Tboil | 619.48 | K | Relay (... Calculated Property |
| Tc | 822.85 | K | Relay (... Calculated Property |
| Tfus | 348.05 | K | Relay (... Calculated Property |
| Vc | 1.000 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [815.15; 861.42] | J/mol×K | [898.40; 1110.35] | 
|
| Cp,gas | 815.15 | J/mol×K | 898.40 | Joback Calculated Property |
| Cp,gas | 824.63 | J/mol×K | 933.72 | Joback Calculated Property |
| Cp,gas | 833.28 | J/mol×K | 969.05 | Joback Calculated Property |
| Cp,gas | 841.20 | J/mol×K | 1004.37 | Joback Calculated Property |
| Cp,gas | 848.47 | J/mol×K | 1039.70 | Joback Calculated Property |
| Cp,gas | 855.18 | J/mol×K | 1075.02 | Joback Calculated Property |
| Cp,gas | 861.42 | J/mol×K | 1110.35 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Trichlamide, N-pentafluoropropionyl-.
Sources
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