- InChI
- InChI=1S/C12H13F2NO2/c13-9-4-1-5-10(14)11(9)12(16)15-7-8-3-2-6-17-8/h1,4-5,8H,2-3,6-7H2,(H,15,16)
- InChI Key
- GZOWKIITIDVBIP-UHFFFAOYSA-N
- Formula
- C12H13F2NO2
- SMILES
- O=C(NCC1CCCO1)c1c(F)cccc1F
- Molecular Weight1
- 241.23
- 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° | -335.41 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -600.27 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 34.87 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 62.22 | kJ/mol | Joback Calculated Property |
| log10WS | -3.25 | Crippen Calculated Property | |
| logPoct/wat | 1.874 | Crippen Calculated Property | |
| McVol | 166.280 | ml/mol | McGowan Calculated Property |
| Pc | 2735.42 | kPa | Joback Calculated Property |
| Inp | [1804.00; 1804.00] |
|
|
| Inp | 1804.00 | NIST | |
| Inp | 1804.00 | NIST | |
| Tboil | 655.41 | K | Joback Calculated Property |
| Tc | 871.46 | K | Joback Calculated Property |
| Tfus | 417.70 | K | Joback Calculated Property |
| Vc | 0.638 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [453.96; 527.29] | J/mol×K | [655.41; 871.46] |
|
| Cp,gas | 453.96 | J/mol×K | 655.41 | Joback Calculated Property |
| Cp,gas | 468.56 | J/mol×K | 691.42 | Joback Calculated Property |
| Cp,gas | 482.16 | J/mol×K | 727.43 | Joback Calculated Property |
| Cp,gas | 494.79 | J/mol×K | 763.43 | Joback Calculated Property |
| Cp,gas | 506.49 | J/mol×K | 799.44 | Joback Calculated Property |
| Cp,gas | 517.31 | J/mol×K | 835.45 | Joback Calculated Property |
| Cp,gas | 527.29 | J/mol×K | 871.46 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, N-tetrahydrofurfuryl-2,6-difluoro-.
Sources
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