- InChI
- InChI=1S/C18H26F3NO/c1-3-4-5-6-7-8-9-10-13-22(2)18(23)14-11-12-15(19)17(21)16(14)20/h11-12H,3-10,13H2,1-2H3
- InChI Key
- BBASOXGNNHQMTB-UHFFFAOYSA-N
- Formula
- C18H26F3NO
- SMILES
-
CCCCCCCCCCN(C)C(=O)c1ccc(F)c(F
)c1F - Molecular Weight1
- 329.40
- 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 | 0.8607 | Relay (1.0) Calculated Property | |
| ΔfG° | -418.37 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -802.87 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 49.11 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 91.67 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.01 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.21 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.317 | Crippen Calculated Property | |
| McVol | 257.580 | ml/mol | McGowan Calculated Property |
| Pc | 1337.84 | kPa | Joback Calculated Property |
| Inp | [2115.00; 2115.00] |
|
|
| Inp | 2115.00 | NIST | |
| Inp | 2115.00 | NIST | |
| Tboil | 603.12 | K | Relay (1.0) Calculated Property |
| Tc | 792.26 | K | Relay (1.0) Calculated Property |
| Tfus | 308.17 | K | Relay (1.0) Calculated Property |
| Vc | 0.973 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [744.82; 829.98] | J/mol×K | [716.98; 894.19] |
|
| Cp,gas | 744.82 | J/mol×K | 716.98 | Joback Calculated Property |
| Cp,gas | 761.02 | J/mol×K | 746.51 | Joback Calculated Property |
| Cp,gas | 776.37 | J/mol×K | 776.05 | Joback Calculated Property |
| Cp,gas | 790.92 | J/mol×K | 805.58 | Joback Calculated Property |
| Cp,gas | 804.68 | J/mol×K | 835.12 | Joback Calculated Property |
| Cp,gas | 817.69 | J/mol×K | 864.65 | Joback Calculated Property |
| Cp,gas | 829.98 | J/mol×K | 894.19 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, n-decyl-N-methyl-2,3,4-trifluoro-.
Sources
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