Structure Info
- Chemspace ID
- CSCS00135252958 (Synthesis)
- IUPAC Name
- 1-(2-bromo-3-iodo-4-methylphenyl)ethan-1-one
- Mol formula
- C9H8BrIO
- Mol weight
- 339 Da
- Catalog Number(s)
- BBV-148325358, CSC135252958, FCH19998074
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.74
- Heavy atoms count
- 12
- Rotatable bond count
- 1
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.222
- Polar surface area (Å)
- 17
- Hydrogen bond acceptors count
- 1
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSCS00135252958
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