Structure Info
- Chemspace ID
- CSMB20482558650 (Enamine MADE)
- IUPAC Name
- 1-{6-bromo-2-chloro-4-methoxy-3-[(2S)-2-methylbutoxy]phenyl}methanamine
- Mol formula
- C13H19BrClNO2
- Mol weight
- 337 Da
- Catalog Number(s)
- BBV-1332322122
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.85
- Heavy atoms count
- 18
- Rotatable bond count
- 6
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.53846153846154
- Polar surface area (Å)
- 44
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB20482558650
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