Structure Info
- Chemspace ID
- CSMB00021127221 (Enamine MADE)
- MFCD
- MFCD31409424
- IUPAC Name
- 4-(1-aminoethyl)-2-chloro-6-(trifluoromethyl)phenol
- Mol formula
- C9H9ClF3NO
- Mol weight
- 240 Da
- Catalog Number(s)
- BBV-95920725, CSC021127221, FCH6997044
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.85
- Heavy atoms count
- 15
- Rotatable bond count
- 2
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.333
- Polar surface area (Å)
- 46
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 2
- Zoom the structure
- CSMB00021127221
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