Structure Info
- Chemspace ID
- CSMB20471907234 (Enamine MADE)
- IUPAC Name
- 8-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,4-dihydro-1H-2-benzopyran-6-carboxylic acid
- Mol formula
- C16H21BO5
- Mol weight
- 304 Da
- Catalog Number(s)
- BBV-1321277332
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.14
- Heavy atoms count
- 22
- Rotatable bond count
- 2
- Number of rings
- 3
- Carbon bond saturation, Fsp3
- 0.562
- Polar surface area (Å)
- 65
- Hydrogen bond acceptors count
- 5
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB20471907234
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