Structure Info
- Chemspace ID
- CSCS03552127542 (Synthesis)
- IUPAC Name
- 3-hydroxy-1-methyl-1H-pyrazole-4,5-dicarboxylic acid
- Mol formula
- C6H6N2O5
- Mol weight
- 186 Da
- Catalog Number(s)
- BBV-397175142
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 0.58
- Heavy atoms count
- 13
- Rotatable bond count
- 2
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.166
- Polar surface area (Å)
- 113
- Hydrogen bond acceptors count
- 6
- Hydrogen bond donors count
- 3
- Zoom the structure
- CSCS03552127542
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