Structure Info
- Chemspace ID
- CSMB02184442064 (Enamine MADE)
- IUPAC Name
- 3-bromo-5-[(1-ethynylcyclobutoxy)methyl]benzoic acid
- Mol formula
- C14H13BrO3
- Mol weight
- 309 Da
- Catalog Number(s)
- BBV-216798420
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.34
- Heavy atoms count
- 18
- Rotatable bond count
- 4
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.357
- Polar surface area (Å)
- 47
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB02184442064
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