Structure Info
- Chemspace ID
- CSMB20489944048 (Enamine MADE)
- IUPAC Name
- 1-bromo-3-chloro-4-iodo-2-(²H₃)methoxy-5-methylbenzene
- Mol formula
- C8H7BrClIO
- Mol weight
- 364 Da
- Catalog Number(s)
- BBV-1339958043
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 4.63
- Heavy atoms count
- 12
- 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
- CSMB20489944048
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