Structure Info
- Chemspace ID
- CSMB00697546449 (Enamine MADE)
- IUPAC Name
- but-3-en-2-yl 5-bromo-3-methylpyridine-2-carboxylate
- Mol formula
- C11H12BrNO2
- Mol weight
- 270 Da
- Catalog Number(s)
- BBV-322960415, CSCR00697546449, Z3160581018, s_276436_14080680_14109502, s_276436____14080680____14109502
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.37
- Heavy atoms count
- 15
- Rotatable bond count
- 4
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.272
- Polar surface area (Å)
- 39
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB00697546449
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