- InChI
- InChI=1S/C16H20N2O2S/c1-12-5-10-16(11-13(12)2)21(19,20)17-14-6-8-15(9-7-14)18(3)4/h5-11,17H,1-4H3
- InChI Key
- IUDCJKFTUQYUBX-UHFFFAOYSA-N
- Formula
- C16H20N2O2S
- SMILES
-
Cc1ccc(S(=O)(=O)Nc2ccc(N(C)C)c
c2)cc1C - Molecular Weight1
- 304.41
- CAS
- 19770-73-1
- ω : Acentric Factor.
- 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).
- 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 | 0.7827 | Relay (1.0) Calculated Property | |
| ΔfG° | 11.40 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -166.36 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 43.61 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 108.83 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 6.84 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.28 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.170 | Crippen Calculated Property | |
| McVol | 236.830 | ml/mol | McGowan Calculated Property |
| Pc | 2574.11 | kPa | Joback Calculated Property |
| Tboil | 673.41 | K | Relay (1.0) Calculated Property |
| Tc | 999.33 | K | Relay (1.0) Calculated Property |
| Tfus | 449.73 | K | Relay (1.0) Calculated Property |
| Vc | 0.843 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [655.26; 733.60] | J/mol×K | [744.17; 963.23] | 
|
| Cp,gas | 655.26 | J/mol×K | 744.17 | Joback Calculated Property |
| Cp,gas | 671.34 | J/mol×K | 780.68 | Joback Calculated Property |
| Cp,gas | 686.16 | J/mol×K | 817.19 | Joback Calculated Property |
| Cp,gas | 699.76 | J/mol×K | 853.70 | Joback Calculated Property |
| Cp,gas | 712.17 | J/mol×K | 890.21 | Joback Calculated Property |
| Cp,gas | 723.43 | J/mol×K | 926.72 | Joback Calculated Property |
| Cp,gas | 733.60 | J/mol×K | 963.23 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Aniline, n,n-dimethyl-p-(3,4-dimethylphenylsulfonamido)-.
Sources
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