- InChI
- InChI=1S/C3H5N3/c4-3-1-5-6-2-3/h1-2H,4H2,(H,5,6)
- InChI Key
- AXINVSXSGNSVLV-UHFFFAOYSA-N
- Formula
- C3H5N3
- SMILES
- Nc1cn[nH]c1
- Molecular Weight1
- 83.09
- CAS
- 28466-26-4
- PAff : Proton affinity (kJ/mol).
- BasG : Gas basicity (kJ/mol).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| PAff | 907.60 | kJ/mol | NIST |
| BasG | 874.00 | kJ/mol | NIST |
| log10WS | -0.09 | Crippen Calculated Property | |
| logPoct/wat | -0.490 | Crippen Calculated Property | |
| McVol | 63.610 | ml/mol | McGowan Calculated Property |
Similar Compounds
Find more compounds similar to 4-NH2-pyrazole.
Sources
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