Structure Info
- Chemspace ID
- CSMB06263122868 (Enamine MADE)
- IUPAC Name
- methyl 4-ethynyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate
- Mol formula
- C16H19BO4
- Mol weight
- 286 Da
- Catalog Number(s)
- BBV-467211089
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 4.23
- Heavy atoms count
- 21
- Rotatable bond count
- 3
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.437
- Polar surface area (Å)
- 45
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB06263122868
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