Structure Info
- Chemspace ID
- CSMB02157362184 (Enamine MADE)
- IUPAC Name
- 3-bromo-5-[(1-ethynylcyclopropoxy)methyl]benzoic acid
- Mol formula
- C13H11BrO3
- Mol weight
- 295 Da
- Catalog Number(s)
- BBV-207143720
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.89
- Heavy atoms count
- 17
- Rotatable bond count
- 4
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.307
- Polar surface area (Å)
- 47
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB02157362184
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