Structure Info
- Chemspace ID
- CSMB00022402814 (Enamine MADE)
- IUPAC Name
- 1-(4-amino-3,5-dichlorophenyl)-3-methylbut-3-en-1-ol
- Mol formula
- C11H13Cl2NO
- Mol weight
- 246 Da
- Catalog Number(s)
- BBV-93194045, CSC022402814
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.91
- Heavy atoms count
- 15
- Rotatable bond count
- 3
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.272
- Polar surface area (Å)
- 46
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 2
- Zoom the structure
- CSMB00022402814
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