- InChI
- InChI=1S/C14H26Cl3NO/c1-3-5-7-9-11-18(12-10-8-6-4-2)13(19)14(15,16)17/h3-12H2,1-2H3
- InChI Key
- KUPGOOKIYUHFCE-UHFFFAOYSA-N
- Formula
- C14H26Cl3NO
- SMILES
-
CCCCCCN(CCCCCC)C(=O)C(Cl)(Cl)C
l - Molecular Weight1
- 330.72
- 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 | 0.7040 | Relay (1.0) Calculated Property | |
| ΔfG° | 15.91 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -465.07 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 41.81 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 75.40 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.75 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.67 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.346 | Crippen Calculated Property | |
| McVol | 256.390 | ml/mol | McGowan Calculated Property |
| Pc | 1487.29 | kPa | Joback Calculated Property |
| Inp | [2020.00; 2020.00] |
|
|
| Inp | 2020.00 | NIST | |
| Inp | 2020.00 | NIST | |
| Tboil | 586.61 | K | Relay (1.0) Calculated Property |
| Tc | 779.74 | K | Relay (1.0) Calculated Property |
| Tfus | 273.23 | K | Relay (1.0) Calculated Property |
| Vc | 0.945 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [676.97; 757.07] | J/mol×K | [695.09; 883.04] |
|
| Cp,gas | 676.97 | J/mol×K | 695.09 | Joback Calculated Property |
| Cp,gas | 692.34 | J/mol×K | 726.42 | Joback Calculated Property |
| Cp,gas | 706.84 | J/mol×K | 757.74 | Joback Calculated Property |
| Cp,gas | 720.51 | J/mol×K | 789.07 | Joback Calculated Property |
| Cp,gas | 733.40 | J/mol×K | 820.39 | Joback Calculated Property |
| Cp,gas | 745.57 | J/mol×K | 851.72 | Joback Calculated Property |
| Cp,gas | 757.07 | J/mol×K | 883.04 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Trichloroacetamide, N,N-dihexyl-.
Sources
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