Structure Info
- Chemspace ID
- CSCS06645129484 (Synthesis)
- MFCD
- MFCD24431992
- IUPAC Name
- (1S)-1-[3-chloro-5-(trifluoromethyl)phenyl]-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)butan-1-amine hydrochloride
- Mol formula
- C17H25BCl2F3NO2
- Mol weight
- 414 Da
- Catalog Number(s)
- AH-41454
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 5.18
- Heavy atoms count
- 26
- Rotatable bond count
- 6
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.647
- Polar surface area (Å)
- 44
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSCS06645129484
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