Structure Info
- Chemspace ID
- CSMB06442906458 (Enamine MADE)
- CAS
- 137741-19-6
- IUPAC Name
- {3-bromobicyclo[1.1.1]pentan-1-yl}methyl 4-methylbenzene-1-sulfonate
- Mol formula
- C13H15BrO3S
- Mol weight
- 331 Da
- Catalog Number(s)
- BBV-662456240, EN300-37374110
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.25
- Heavy atoms count
- 18
- Rotatable bond count
- 4
- Number of rings
- 3
- Carbon bond saturation, Fsp3
- 0.538
- Polar surface area (Å)
- 43
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB06442906458
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