- InChI
- InChI=1S/C10H7ClF5NO/c1-5-2-3-6(11)4-7(5)17-8(18)9(12,13)10(14,15)16/h2-4H,1H3,(H,17,18)
- InChI Key
- CYVMFAFINLFGOI-UHFFFAOYSA-N
- Formula
- C10H7ClF5NO
- SMILES
-
Cc1ccc(Cl)cc1NC(=O)C(F)(F)C(F)
(F)F - Molecular Weight1
- 287.61
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | -893.36 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1109.04 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 26.39 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 52.34 | kJ/mol | Joback Calculated Property |
| log10WS | -4.23 | Crippen Calculated Property | |
| logPoct/wat | 3.785 | Crippen Calculated Property | |
| McVol | 160.640 | ml/mol | McGowan Calculated Property |
| Pc | 2438.65 | kPa | Joback Calculated Property |
| Inp | 1363.00 | NIST | |
| Tboil | 596.20 | K | Joback Calculated Property |
| Tc | 792.51 | K | Joback Calculated Property |
| Tfus | 394.22 | K | Joback Calculated Property |
| Vc | 0.645 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [396.51; 449.13] | J/mol×K | [596.20; 792.51] | 
|
| Cp,gas | 396.51 | J/mol×K | 596.20 | Joback Calculated Property |
| Cp,gas | 407.19 | J/mol×K | 628.92 | Joback Calculated Property |
| Cp,gas | 417.04 | J/mol×K | 661.64 | Joback Calculated Property |
| Cp,gas | 426.09 | J/mol×K | 694.36 | Joback Calculated Property |
| Cp,gas | 434.43 | J/mol×K | 727.08 | Joback Calculated Property |
| Cp,gas | 442.09 | J/mol×K | 759.79 | Joback Calculated Property |
| Cp,gas | 449.13 | J/mol×K | 792.51 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 5-Chloro-2-methyl-aniline, N-pentafluoropropionyl-.
Sources
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