- InChI
- InChI=1S/C12H13Cl3N2/c1-2-3-4-5-6-16-17-12-10(14)7-9(13)8-11(12)15/h4-8,17H,2-3H2,1H3/b5-4+,16-6+
- InChI Key
- HYWZYTFTKRTXFT-TUQJRISCSA-N
- Formula
- C12H13Cl3N2
- SMILES
- CCCC=CC=NNc1c(Cl)cc(Cl)cc1Cl
- Molecular Weight1
- 291.60
- ΔfH°gas : Enthalpy of formation 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).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfH°gas | 116.80 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 69.43 | kJ/mol | Joback Calculated Property |
| log10WS | -5.64 | Crippen Calculated Property | |
| logPoct/wat | 5.401 | Crippen Calculated Property | |
| McVol | 204.260 | ml/mol | McGowan Calculated Property |
| Pc | 2001.91 | kPa | Joback Calculated Property |
| Inp | [2174.00; 2174.00] |
|
|
| Inp | 2174.00 | NIST | |
| Inp | 2174.00 | NIST | |
| Tboil | 758.88 | K | Joback Calculated Property |
| Tc | 994.50 | K | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Hexenal (E), 2,4,6-trichlorophenyl hydrazone, #1.
Sources
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