Structure Info
- Chemspace ID
- CSMB20471896349 (Enamine MADE)
- IUPAC Name
- 4-(difluoromethyl)-2,5-dimethoxy-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid
- Mol formula
- C16H21BF2O6
- Mol weight
- 358 Da
- Catalog Number(s)
- BBV-1321266121
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.08
- Heavy atoms count
- 25
- Rotatable bond count
- 5
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.562
- Polar surface area (Å)
- 74
- Hydrogen bond acceptors count
- 6
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB20471896349
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