Structure Info
- Chemspace ID
- CSMB12486719387 (Enamine MADE)
- IUPAC Name
- 1-bromo-4-ethynyl-5-fluoro-2-methylbenzene
- Mol formula
- C9H6BrF
- Mol weight
- 213 Da
- Catalog Number(s)
- BBV-1022798502, a6_21439_334543
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.55
- Heavy atoms count
- 11
- Rotatable bond count
- 0
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.111
- Polar surface area (Å)
- 0
- Hydrogen bond acceptors count
- 0
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB12486719387
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