Structure Info
- Chemspace ID
- CSMB07190729477 (Enamine MADE)
- IUPAC Name
- 1-bromo-3-chloro-2-(²H₃)methoxy-5-methylbenzene
- Mol formula
- C8H8BrClO
- Mol weight
- 239 Da
- Catalog Number(s)
- BBV-894781652
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.7
- Heavy atoms count
- 11
- Rotatable bond count
- 1
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.25
- Polar surface area (Å)
- 9
- Hydrogen bond acceptors count
- 1
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB07190729477
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