Structure Info
- Chemspace ID
- CSMB20471899646 (Enamine MADE)
- IUPAC Name
- 5-[(tert-butoxy)carbonyl]-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)benzoic acid
- Mol formula
- C19H24BF3O6
- Mol weight
- 416 Da
- Catalog Number(s)
- BBV-1321269509
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 5.28
- Heavy atoms count
- 29
- Rotatable bond count
- 6
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.578
- Polar surface area (Å)
- 82
- Hydrogen bond acceptors count
- 5
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB20471899646
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