- InChI
- InChI=1S/C24H28N2O4S2/c1-5-25(6-2)21-11-13-22(14-12-21)26(31(27,28)23-15-7-19(3)8-16-23)32(29,30)24-17-9-20(4)10-18-24/h7-18H,5-6H2,1-4H3
- InChI Key
- SZAOAPOETWBAFD-UHFFFAOYSA-N
- Formula
- C24H28N2O4S2
- SMILES
-
CCN(CC)c1ccc(N(S(=O)(=O)c2ccc(
C)cc2)S(=O)(=O)c2ccc(C)cc2)cc1 - Molecular Weight1
- 472.62
- CAS
- 19770-88-8
- 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 | 0.9622 | Relay (1.0) Calculated Property | |
| ΔfG° | -255.98 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -411.87 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 67.67 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 115.83 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 6.52 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.29 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.734 | Crippen Calculated Property | |
| McVol | 353.880 | ml/mol | McGowan Calculated Property |
| Pc | 1944.08 | kPa | Joback Calculated Property |
| Tboil | 769.42 | K | Relay (1.0) Calculated Property |
| Tc | 1120.78 | K | Relay (1.0) Calculated Property |
| Tfus | 416.32 | K | Relay (1.0) Calculated Property |
| Vc | 1.238 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1094.98; 1148.59] | J/mol×K | [963.94; 1191.77] | 
|
| Cp,gas | 1094.98 | J/mol×K | 963.94 | Joback Calculated Property |
| Cp,gas | 1107.94 | J/mol×K | 1001.91 | Joback Calculated Property |
| Cp,gas | 1119.20 | J/mol×K | 1039.88 | Joback Calculated Property |
| Cp,gas | 1128.82 | J/mol×K | 1077.85 | Joback Calculated Property |
| Cp,gas | 1136.87 | J/mol×K | 1115.83 | Joback Calculated Property |
| Cp,gas | 1143.44 | J/mol×K | 1153.80 | Joback Calculated Property |
| Cp,gas | 1148.59 | J/mol×K | 1191.77 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to P-phenylenediamine, n,n-diethyl-n',n'-bis(p-tolylsulfonyl)-.
Sources
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