- InChI
- InChI=1S/C12H10N2O2/c15-14(16)12-8-4-7-11(9-12)13-10-5-2-1-3-6-10/h1-9,13H
- InChI Key
- VNRHTFXMONFRSL-UHFFFAOYSA-N
- Formula
- C12H10N2O2
- SMILES
-
O=[N+]([O-])c1cccc(Nc2ccccc2)c
1 - Molecular Weight1
- 214.22
- CAS
- 4531-79-7
- Other Names
-
- Diphenylamine, 3-nitro-
- m-Nitrodiphenylamine
- 3-Nitrodiphenylamine
- 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° | 390.29 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 213.29 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 30.99 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 70.55 | kJ/mol | Joback Calculated Property |
| log10WS | -3.93 | Crippen Calculated Property | |
| logPoct/wat | 3.338 | Crippen Calculated Property | |
| McVol | 159.820 | ml/mol | McGowan Calculated Property |
| Pc | 3468.36 | kPa | Joback Calculated Property |
| Tboil | 734.31 | K | Joback Calculated Property |
| Tc | 1004.26 | K | Joback Calculated Property |
| Tfus | 486.63 | K | Joback Calculated Property |
| Vc | 0.609 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [421.30; 482.14] | J/mol×K | [734.31; 1004.26] | 
|
| Cp,gas | 421.30 | J/mol×K | 734.31 | Joback Calculated Property |
| Cp,gas | 434.25 | J/mol×K | 779.30 | Joback Calculated Property |
| Cp,gas | 445.95 | J/mol×K | 824.29 | Joback Calculated Property |
| Cp,gas | 456.48 | J/mol×K | 869.29 | Joback Calculated Property |
| Cp,gas | 465.95 | J/mol×K | 914.28 | Joback Calculated Property |
| Cp,gas | 474.47 | J/mol×K | 959.27 | Joback Calculated Property |
| Cp,gas | 482.14 | J/mol×K | 1004.26 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzenamine, 3-nitro-N-phenyl-.
Sources
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