- InChI
- InChI=1S/C18H34Cl3NO/c1-5-9-11-15(7-3)13-22(17(23)18(19,20)21)14-16(8-4)12-10-6-2/h15-16H,5-14H2,1-4H3
- InChI Key
- AQTKUBSOCLDIJW-UHFFFAOYSA-N
- Formula
- C18H34Cl3NO
- SMILES
-
CCCCC(CC)CN(CC(CC)CCCC)C(=O)C(
Cl)(Cl)Cl - Molecular Weight1
- 386.83
- 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 | 0.7347 | Relay (1.0) Calculated Property | |
| ΔfG° | 44.71 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -575.38 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 45.13 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 85.40 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.22 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.77 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.618 | Crippen Calculated Property | |
| McVol | 312.750 | ml/mol | McGowan Calculated Property |
| Pc | 1140.57 | kPa | Joback Calculated Property |
| Inp | [2188.00; 2188.00] |
|
|
| Inp | 2188.00 | NIST | |
| Inp | 2188.00 | NIST | |
| Tboil | 613.35 | K | Relay (1.0) Calculated Property |
| Tc | 805.61 | K | Relay (1.0) Calculated Property |
| Tfus | 252.07 | K | Relay (1.0) Calculated Property |
| Vc | 1.117 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [904.29; 993.41] | J/mol×K | [785.73; 976.74] |
|
| Cp,gas | 904.29 | J/mol×K | 785.73 | Joback Calculated Property |
| Cp,gas | 921.37 | J/mol×K | 817.57 | Joback Calculated Property |
| Cp,gas | 937.47 | J/mol×K | 849.40 | Joback Calculated Property |
| Cp,gas | 952.66 | J/mol×K | 881.24 | Joback Calculated Property |
| Cp,gas | 967.01 | J/mol×K | 913.07 | Joback Calculated Property |
| Cp,gas | 980.57 | J/mol×K | 944.91 | Joback Calculated Property |
| Cp,gas | 993.41 | J/mol×K | 976.74 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Trichloroacetamide, N,N-bis(2-ethylhexyl)-.
Sources
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