- InChI
- InChI=1S/C6H7N3O/c7-5-2-1-4(3-9-5)6(8)10/h1-3H,(H2,7,9)(H2,8,10)
- InChI Key
- ZLWYEPMDOUQDBW-UHFFFAOYSA-N
- Formula
- C6H7N3O
- SMILES
- NC(=O)c1ccc(N)nc1
- Molecular Weight1
- 137.14
- CAS
- 329-89-5
- Other Names
-
- 3-Pyridinecarboxamide, 6-amino-
- 2-Amino-5-carbamoylpyridine
- Nicotinamide, 6-amino-
- FDA 0121
- NSC 21206
- U-8774
- 6-Amino-nicotinsaeureamid
- 6-Aminonicotinic acid amide
- 6-Aminonikotinsaeureamid
- 6-AN
- 6-ANA
- SR 4388
- 6-Amino-3-pyridinecarboxamide
- 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 | 0.6552 | Relay (... Calculated Property | |
| ΔfG° | 139.75 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -99.96 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 83.85 | kJ/mol | Relay (... Calculated Property |
| IE | 8.59 | eV | Relay (... Calculated Property |
| log10WS | -1.53 | Relay (... Calculated Property | |
| logPoct/wat | -0.237 | Crippen Calculated Property | |
| McVol | 103.150 | ml/mol | McGowan Calculated Property |
| Pc | 4546.79 | kPa | Relay (... Calculated Property ⚠️ |
| Tboil | 577.55 | K | Relay (... Calculated Property |
| Tc | 854.27 | K | Relay (... Calculated Property |
| Tfus | 445.12 | K | Relay (... Calculated Property |
| Vc | 0.370 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to 6-Aminonicotinamide.
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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