Structure Info
- Chemspace ID
- CSMB00102812620 (Enamine MADE)
- CAS
- 2171858-54-9
- IUPAC Name
- (8-bromocuban-1-yl)methyl 4-methylbenzene-1-sulfonate
- Mol formula
- C16H15BrO3S
- Mol weight
- 367 Da
- Catalog Number(s)
- BBV-118249127, CSC102812620, EN300-1585724, FCH13724653
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.48
- Heavy atoms count
- 21
- Rotatable bond count
- 4
- Number of rings
- 6
- Carbon bond saturation, Fsp3
- 0.625
- Polar surface area (Å)
- 43
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB00102812620
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