- InChI
- InChI=1S/C18H14N2O2/c21-20(22)18-13-11-17(12-14-18)19(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-14H
- InChI Key
- UQOKZDUUBVGFAK-UHFFFAOYSA-N
- Formula
- C18H14N2O2
- SMILES
-
O=[N+]([O-])c1ccc(N(c2ccccc2)c
2ccccc2)cc1 - Molecular Weight1
- 290.32
- CAS
- 4316-57-8
- Other Names
-
- p-nitrotriphenylamine
- 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 | 0.7186 | Relay (1.0) Calculated Property | |
| ΔfG° | 574.61 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 287.25 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 38.49 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 109.11 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.29 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.31 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.065 | Crippen Calculated Property | |
| McVol | 220.600 | ml/mol | McGowan Calculated Property |
| Pc | 2608.40 | kPa | Joback Calculated Property |
| Tboil | 683.80 | K | Relay (1.0) Calculated Property |
| Tc | 1048.01 | K | Relay (1.0) Calculated Property |
| Tfus | 414.43 | K | Relay (1.0) Calculated Property |
| Vc | 0.766 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [636.02; 702.20] | J/mol×K | [860.54; 1140.76] | 
|
| Cp,gas | 636.02 | J/mol×K | 860.54 | Joback Calculated Property |
| Cp,gas | 649.95 | J/mol×K | 907.24 | Joback Calculated Property |
| Cp,gas | 662.47 | J/mol×K | 953.95 | Joback Calculated Property |
| Cp,gas | 673.76 | J/mol×K | 1000.65 | Joback Calculated Property |
| Cp,gas | 684.02 | J/mol×K | 1047.35 | Joback Calculated Property |
| Cp,gas | 693.43 | J/mol×K | 1094.06 | Joback Calculated Property |
| Cp,gas | 702.20 | J/mol×K | 1140.76 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to (4-Nitrophenyl)diphenylamine.
Sources
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