- InChI
- InChI=1S/C16H21ClFNO3/c1-3-4-5-6-10-22-16(21)11(2)19-15(20)12-8-7-9-13(17)14(12)18/h7-9,11H,3-6,10H2,1-2H3,(H,19,20)
- InChI Key
- LJOKYNXLEWIOSS-UHFFFAOYSA-N
- Formula
- C16H21ClFNO3
- SMILES
-
CCCCCCOC(=O)C(C)NC(=O)c1cccc(C
l)c1F - Molecular Weight1
- 329.79
- 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° | -305.64 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -681.02 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 43.70 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 80.33 | kJ/mol | Joback Calculated Property |
| log10WS | -5.16 | Crippen Calculated Property | |
| logPoct/wat | 3.721 | Crippen Calculated Property | |
| McVol | 245.540 | ml/mol | McGowan Calculated Property |
| Pc | 1728.90 | kPa | Joback Calculated Property |
| Inp | 2319.00 | NIST | |
| Tboil | 818.71 | K | Joback Calculated Property |
| Tc | 1024.18 | K | Joback Calculated Property |
| Tfus | 511.80 | K | Joback Calculated Property |
| Vc | 0.950 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [709.85; 775.55] | J/mol×K | [818.71; 1024.18] | 
|
| Cp,gas | 709.85 | J/mol×K | 818.71 | Joback Calculated Property |
| Cp,gas | 723.12 | J/mol×K | 852.95 | Joback Calculated Property |
| Cp,gas | 735.43 | J/mol×K | 887.20 | Joback Calculated Property |
| Cp,gas | 746.80 | J/mol×K | 921.44 | Joback Calculated Property |
| Cp,gas | 757.26 | J/mol×K | 955.69 | Joback Calculated Property |
| Cp,gas | 766.84 | J/mol×K | 989.93 | Joback Calculated Property |
| Cp,gas | 775.55 | J/mol×K | 1024.18 | Joback Calculated Property |
Similar Compounds
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Sources
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