Structure Info
- Chemspace ID
- CSMB00021024593 (Enamine MADE)
- CAS
- 1000990-16-8
- MFCD
- MFCD33416788
- IUPAC Name
- 2-bromo-3,5-dimethylbenzaldehyde
- Mol formula
- C9H9BrO
- Mol weight
- 213 Da
- Catalog Number(s)
- BBV-95430950, CSC021024593, EN300-6505405, FCH6541503
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.48
- Heavy atoms count
- 11
- 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
- CSMB00021024593
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