- InChI
- InChI=1S/C9H9Cl3N2/c1-2-3-13-14-9-7(11)4-6(10)5-8(9)12/h3-5,14H,2H2,1H3/b13-3+
- InChI Key
- LBBCNSGFIOMURM-QLKAYGNNSA-N
- Formula
- C9H9Cl3N2
- SMILES
- CCC=NNc1c(Cl)cc(Cl)cc1Cl
- Molecular Weight1
- 251.54
- 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 | 61.50 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 62.80 | kJ/mol | Joback Calculated Property |
| log10WS | -4.53 | Crippen Calculated Property | |
| logPoct/wat | 4.455 | Crippen Calculated Property | |
| McVol | 166.290 | ml/mol | McGowan Calculated Property |
| Pc | 2502.50 | kPa | Joback Calculated Property |
| Inp | [1846.00; 1895.00] |
|
|
| Inp | 1846.00 | NIST | |
| Inp | 1895.00 | NIST | |
| Inp | 1846.00 | NIST | |
| Tboil | 686.08 | K | Joback Calculated Property |
| Tc | 926.69 | K | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Propanal, 2,4,6-trichlorophenyl hydrazone, #1.
Sources
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