- InChI
- InChI=1S/C19H29ClFNO/c1-3-5-7-9-14-22(15-10-8-6-4-2)19(23)16-12-11-13-17(20)18(16)21/h11-13H,3-10,14-15H2,1-2H3
- InChI Key
- XSNYXOGPWYXVNN-UHFFFAOYSA-N
- Formula
- C19H29ClFNO
- SMILES
-
CCCCCCN(CCCCCC)C(=O)c1cccc(Cl)
c1F - Molecular Weight1
- 341.89
- 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° | -22.63 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -478.80 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 50.13 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 73.84 | kJ/mol | Joback Calculated Property |
| log10WS | -6.82 | Crippen Calculated Property | |
| logPoct/wat | 6.082 | Crippen Calculated Property | |
| McVol | 280.370 | ml/mol | McGowan Calculated Property |
| Pc | 1310.85 | kPa | Joback Calculated Property |
| Inp | 2389.00 | NIST | |
| Tboil | 773.77 | K | Joback Calculated Property |
| Tc | 964.69 | K | Joback Calculated Property |
| Tfus | 468.26 | K | Joback Calculated Property |
| Vc | 1.083 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [818.01; 904.52] | J/mol×K | [773.77; 964.69] | 
|
| Cp,gas | 818.01 | J/mol×K | 773.77 | Joback Calculated Property |
| Cp,gas | 834.67 | J/mol×K | 805.59 | Joback Calculated Property |
| Cp,gas | 850.38 | J/mol×K | 837.41 | Joback Calculated Property |
| Cp,gas | 865.17 | J/mol×K | 869.23 | Joback Calculated Property |
| Cp,gas | 879.09 | J/mol×K | 901.05 | Joback Calculated Property |
| Cp,gas | 892.20 | J/mol×K | 932.87 | Joback Calculated Property |
| Cp,gas | 904.52 | J/mol×K | 964.69 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-Chloro-2-fluorobenzamide, N,N-dihexyl-.
Sources
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