Structure Info
- Chemspace ID
- CSMB00025788093 (Enamine MADE)
- CAS
- 2137691-09-7
- MFCD
- MFCD30750451
- IUPAC Name
- [4-bromo-5-methyl-1-(propan-2-yl)-1H-pyrazol-3-yl]methanol
- Mol formula
- C8H13BrN2O
- Mol weight
- 233 Da
- Catalog Number(s)
- BBV-109403801, CSC025788093, EN300-381616, FCH9072395
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.46
- Heavy atoms count
- 12
- Rotatable bond count
- 2
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.625
- Polar surface area (Å)
- 38
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00025788093
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