- InChI
- InChI=1S/C16H25ClN2/c1-4-5-6-7-8-13-18-16(19(2)3)14-9-11-15(17)12-10-14/h9-12H,4-8,13H2,1-3H3
- InChI Key
- WKAAKJDZAYDGJF-UHFFFAOYSA-N
- Formula
- C16H25ClN2
- SMILES
- CCCCCCCN=C(c1ccc(Cl)cc1)N(C)C
- Molecular Weight1
- 280.84
- 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 | -24.29 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 63.97 | kJ/mol | Joback Calculated Property |
| log10WS | -4.64 | Crippen Calculated Property | |
| logPoct/wat | 4.619 | Crippen Calculated Property | |
| McVol | 240.440 | ml/mol | McGowan Calculated Property |
| Pc | 1505.81 | kPa | Joback Calculated Property |
| Inp | [1966.00; 1966.00] |
|
|
| Inp | 1966.00 | NIST | |
| Inp | 1966.00 | NIST | |
| Tboil | 723.57 | K | Joback Calculated Property |
| Tc | 931.85 | K | Joback Calculated Property |
Similar Compounds
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Sources
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