- InChI
- InChI=1S/C17H25F2NO/c1-3-4-5-6-7-8-9-12-20-17(21)15-14(18)11-10-13(2)16(15)19/h10-11H,3-9,12H2,1-2H3,(H,20,21)
- InChI Key
- DENZTRDAWWPKGX-UHFFFAOYSA-N
- Formula
- C17H25F2NO
- SMILES
- CCCCCCCCCNC(=O)c1c(F)ccc(C)c1F
- Molecular Weight1
- 297.38
- 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 | 0.8424 | Relay (1.0) Calculated Property | |
| ΔfG° | -253.37 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -664.65 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 45.52 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 91.57 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.81 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.92 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.754 | Crippen Calculated Property | |
| McVol | 241.720 | ml/mol | McGowan Calculated Property |
| Pc | 1504.65 | kPa | Joback Calculated Property |
| Inp | [2265.00; 2265.00] |
|
|
| Inp | 2265.00 | NIST | |
| Inp | 2265.00 | NIST | |
| Tboil | 604.96 | K | Relay (1.0) Calculated Property |
| Tc | 832.94 | K | Relay (1.0) Calculated Property |
| Tfus | 338.51 | K | Relay (1.0) Calculated Property |
| Vc | 0.900 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [699.48; 781.42] | J/mol×K | [732.56; 918.84] |
|
| Cp,gas | 699.48 | J/mol×K | 732.56 | Joback Calculated Property |
| Cp,gas | 715.16 | J/mol×K | 763.61 | Joback Calculated Property |
| Cp,gas | 729.99 | J/mol×K | 794.65 | Joback Calculated Property |
| Cp,gas | 744.01 | J/mol×K | 825.70 | Joback Calculated Property |
| Cp,gas | 757.23 | J/mol×K | 856.75 | Joback Calculated Property |
| Cp,gas | 769.69 | J/mol×K | 887.80 | Joback Calculated Property |
| Cp,gas | 781.42 | J/mol×K | 918.84 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, 2,6-difluoro-3-methyl-N-nonyl-.
Sources
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