Structure Info
- Chemspace ID
- CSMB03552292087 (Enamine MADE)
- IUPAC Name
- 3-hydroxy-4-methoxy-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile
- Mol formula
- C14H18BNO4
- Mol weight
- 275 Da
- Catalog Number(s)
- BBV-397484816
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.18
- Heavy atoms count
- 20
- Rotatable bond count
- 2
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.5
- Polar surface area (Å)
- 72
- Hydrogen bond acceptors count
- 5
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB03552292087
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