Structure Info
- Chemspace ID
- CSMB06258446003 (Enamine MADE)
- CAS
- 2918294-00-3
- MFCD
- MFCD30802459, MFCD35122994
- IUPAC Name
- 3-fluoro-4-methoxy-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile
- Mol formula
- C14H17BFNO3
- Mol weight
- 277 Da
- Catalog Number(s)
- AA029I2E, ADB4170147001, BBV-464978842, BD02356424, BM02450, CS-0737906, F553740, G75950, Y223719, Y4182703
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.6
- Heavy atoms count
- 20
- Rotatable bond count
- 2
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.5
- Polar surface area (Å)
- 51
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB06258446003
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