- InChI
- InChI=1S/C10H18F3NO/c1-3-4-5-6-7-8(2)14-9(15)10(11,12)13/h8H,3-7H2,1-2H3,(H,14,15)
- InChI Key
- PCWNWQNPOLREHV-UHFFFAOYSA-N
- Formula
- C10H18F3NO
- SMILES
- CCCCCCC(C)NC(=O)C(F)(F)F
- Molecular Weight1
- 225.25
- CAS
- 96592-05-1
- Other Names
-
- Trifluoroacetamide, N-(1-methylhexyl)
- 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 | 0.5412 | Relay (1.0) Calculated Property | |
| ΔfG° | -590.24 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -991.26 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 26.66 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 58.68 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.52 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.72 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.024 | Crippen Calculated Property | |
| McVol | 168.620 | ml/mol | McGowan Calculated Property |
| Pc | 2047.46 | kPa | Joback Calculated Property |
| Inp | [1065.00; 1065.00] |
|
|
| Inp | 1065.00 | NIST | |
| Inp | 1065.00 | NIST | |
| Tboil | 462.65 | K | Relay (1.0) Calculated Property |
| Tc | 608.56 | K | Relay (1.0) Calculated Property |
| Tfus | 284.69 | K | Relay (1.0) Calculated Property |
| Vc | 0.615 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [421.74; 495.59] | J/mol×K | [526.38; 691.55] |
|
| Cp,gas | 421.74 | J/mol×K | 526.38 | Joback Calculated Property |
| Cp,gas | 435.65 | J/mol×K | 553.91 | Joback Calculated Property |
| Cp,gas | 448.89 | J/mol×K | 581.44 | Joback Calculated Property |
| Cp,gas | 461.48 | J/mol×K | 608.97 | Joback Calculated Property |
| Cp,gas | 473.44 | J/mol×K | 636.49 | Joback Calculated Property |
| Cp,gas | 484.80 | J/mol×K | 664.02 | Joback Calculated Property |
| Cp,gas | 495.59 | J/mol×K | 691.55 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to N-Trifluoroacetyl-2-octylamine.
Sources
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