- InChI
- InChI=1S/C11H11Cl4NO2/c1-11(14,15)10(17)16-4-5-18-9-3-2-7(12)6-8(9)13/h2-3,6H,4-5H2,1H3,(H,16,17)
- InChI Key
- BXHUTYLHWCXPSK-UHFFFAOYSA-N
- Formula
- C11H11Cl4NO2
- SMILES
-
CC(Cl)(Cl)C(O)=NCCOc1ccc(Cl)cc
1Cl - Molecular Weight1
- 331.02
- CAS
- 116402-50-7
- ω : Acentric Factor.
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation 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).
- 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 | 0.7660 | Relay (... Calculated Property | |
| ΔfG° | -86.63 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -379.80 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 110.07 | kJ/mol | Relay (... Calculated Property |
| IE | 8.76 | eV | Relay (... Calculated Property |
| log10WS | -4.97 | Relay (... Calculated Property | |
| logPoct/wat | 4.522 | Crippen Calculated Property | |
| McVol | 208.470 | ml/mol | McGowan Calculated Property |
| Pc | 2210.37 | kPa | Joback Calculated Property |
| Tboil | 615.36 | K | Relay (... Calculated Property |
| Tc | 871.73 | K | Relay (... Calculated Property |
| Tfus | 361.81 | K | Relay (... Calculated Property |
| Vc | 0.727 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to N-2(2,4-dichlorophenoxy)-ethyl alpha,alpha-dichloropropionamide.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) ⚠️ Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
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