- InChI
- InChI=1S/C15H16F3NO2/c16-15(17,18)12-4-1-3-11(9-12)6-7-14(20)19-10-13-5-2-8-21-13/h1,3-4,6-7,9,13H,2,5,8,10H2,(H,19,20)/b7-6+
- InChI Key
- HPOVVGRSTIYLPV-VOTSOKGWSA-N
- Formula
- C15H16F3NO2
- SMILES
-
O=C(C=Cc1cccc(C(F)(F)F)c1)NCC1
CCCO1 - Molecular Weight1
- 299.29
- 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° | -412.27 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -738.36 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 38.90 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 66.08 | kJ/mol | Joback Calculated Property |
| log10WS | -3.97 | Crippen Calculated Property | |
| logPoct/wat | 3.014 | Crippen Calculated Property | |
| McVol | 206.020 | ml/mol | McGowan Calculated Property |
| Pc | 2145.33 | kPa | Joback Calculated Property |
| Inp | [2135.00; 2135.00] |
|
|
| Inp | 2135.00 | NIST | |
| Inp | 2135.00 | NIST | |
| Tboil | 719.27 | K | Joback Calculated Property |
| Tc | 934.41 | K | Joback Calculated Property |
| Tfus | 436.92 | K | Joback Calculated Property |
| Vc | 0.793 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [599.92; 675.24] | J/mol×K | [719.27; 934.41] |
|
| Cp,gas | 599.92 | J/mol×K | 719.27 | Joback Calculated Property |
| Cp,gas | 615.01 | J/mol×K | 755.13 | Joback Calculated Property |
| Cp,gas | 628.96 | J/mol×K | 790.98 | Joback Calculated Property |
| Cp,gas | 641.86 | J/mol×K | 826.84 | Joback Calculated Property |
| Cp,gas | 653.82 | J/mol×K | 862.69 | Joback Calculated Property |
| Cp,gas | 664.91 | J/mol×K | 898.55 | Joback Calculated Property |
| Cp,gas | 675.24 | J/mol×K | 934.41 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to trans-Cinnamamide, N-tetrahydrofurfuryl-3-trifluoromethyl-.
Sources
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