- InChI
- InChI=1S/C9H11N3O2/c1-11(2)7-10-8-3-5-9(6-4-8)12(13)14/h3-7H,1-2H3
- InChI Key
- VBLAVCCSDMDOCP-UHFFFAOYSA-N
- Formula
- C9H11N3O2
- SMILES
- CN(C)C=Nc1ccc([N+](=O)[O-])cc1
- Molecular Weight1
- 193.20
- CAS
- 74739-51-8
- Other Names
-
- Formamidine, 3,3-dimethyl-1-(4-nitrophenyl)
- Formamidine, N,N-dimethyl-N'-(p-nitrophenyl)-
- N'-(4-nitro-phenyl)-N,N-dimethyl-formamidine
- N'-(p-Nitrophenyl)-N,N-dimethylformamidine
- N,N-Dimethyl-N'-(p-nitrophenyl)formamidine
- PAff : Proton affinity (kJ/mol).
- BasG : Gas basicity (kJ/mol).
- ΔfH°gas : Enthalpy of formation 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).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| PAff | 950.20 | kJ/mol | NIST |
| BasG | 917.80 | kJ/mol | NIST |
| ΔfH°gas | 134.96 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 60.51 | kJ/mol | Joback Calculated Property |
| IE | 7.90 ± 0.10 | eV | NIST |
| log10WS | -2.17 | Crippen Calculated Property | |
| logPoct/wat | 1.816 | Crippen Calculated Property | |
| McVol | 146.990 | ml/mol | McGowan Calculated Property |
| Pc | 2887.40 | kPa | Joback Calculated Property |
| Inp | [1968.00; 1968.00] |
|
|
| Inp | 1968.00 | NIST | |
| Inp | 1968.00 | NIST | |
| Inp | 1968.00 | NIST | |
| Tboil | 677.94 | K | Joback Calculated Property |
| Tc | 928.14 | K | Joback Calculated Property |
Similar Compounds
Find more compounds similar to (CH3)2N-CH=N-(4-nitrophenyl).
Sources
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