- InChI
- InChI=1S/C15H18N2O2S/c1-12-4-10-15(11-5-12)20(18,19)16-13-6-8-14(9-7-13)17(2)3/h4-11,16H,1-3H3
- InChI Key
- ZBAWXYZNUKKOKU-UHFFFAOYSA-N
- Formula
- C15H18N2O2S
- SMILES
-
Cc1ccc(S(=O)(=O)Nc2ccc(N(C)C)c
c2)cc1 - Molecular Weight1
- 290.38
- CAS
- 19766-55-3
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | 12.61 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -235.16 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 41.41 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 81.97 | kJ/mol | Joback Calculated Property |
| log10WS | -3.36 | Crippen Calculated Property | |
| logPoct/wat | 2.862 | Crippen Calculated Property | |
| McVol | 222.740 | ml/mol | McGowan Calculated Property |
| Pc | 2890.51 | kPa | Joback Calculated Property |
| Tboil | 716.31 | K | Joback Calculated Property |
| Tc | 937.98 | K | Joback Calculated Property |
| Tfus | 460.38 | K | Joback Calculated Property |
| Vc | 0.839 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [601.56; 679.58] | J/mol×K | [716.31; 937.98] | 
|
| Cp,gas | 601.56 | J/mol×K | 716.31 | Joback Calculated Property |
| Cp,gas | 617.62 | J/mol×K | 753.25 | Joback Calculated Property |
| Cp,gas | 632.39 | J/mol×K | 790.20 | Joback Calculated Property |
| Cp,gas | 645.93 | J/mol×K | 827.14 | Joback Calculated Property |
| Cp,gas | 658.28 | J/mol×K | 864.09 | Joback Calculated Property |
| Cp,gas | 669.48 | J/mol×K | 901.03 | Joback Calculated Property |
| Cp,gas | 679.58 | J/mol×K | 937.98 | Joback Calculated Property |
Similar Compounds
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Sources
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