- InChI
- InChI=1S/C5H4N4O4/c6-5-3(8(10)11)1-7-2-4(5)9(12)13/h1-2H,(H2,6,7)
- InChI Key
- IEUQRKITTGSLJL-UHFFFAOYSA-N
- Formula
- C5H4N4O4
- SMILES
-
Nc1c([N+](=O)[O-])cncc1[N+](=O
)[O-] - Molecular Weight1
- 184.11
- CAS
- 31793-29-0
- Other Names
-
- 4-Amino-3,5-dinitropyridine
- Pyridine, 4-amino-3,5-dinitro-
- ω : Acentric Factor.
- ΔfG° : Standard Gibbs free energy of formation (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).
- 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 | 0.7014 | Relay (... Calculated Property | |
| ΔfG° | 301.72 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | 150.37 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 80.38 | kJ/mol | Relay (... Calculated Property |
| IE | 9.18 | eV | Relay (... Calculated Property |
| log10WS | -2.91 | Relay (... Calculated Property | |
| logPoct/wat | 0.480 | Crippen Calculated Property | |
| McVol | 112.350 | ml/mol | McGowan Calculated Property |
| Pc | 4295.46 | kPa | Relay (... Calculated Property ⚠️ |
| Tboil | 574.80 | K | Relay (... Calculated Property |
| Tc | 889.95 | K | Relay (... Calculated Property |
| Tfus | 492.44 | K | Relay (... Calculated Property |
| Vc | 0.376 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to 4-Pyridinamine, 3,5-dinitro-.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) ⚠️ Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- McGowan Method
- NIST Webbook
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