Structure Info
- Chemspace ID
- CSMB20523294007 (Enamine MADE)
- IUPAC Name
- 3-chloro-2-(4-chlorobut-2-en-2-yl)aniline
- Mol formula
- C10H11Cl2N
- Mol weight
- 216 Da
- Catalog Number(s)
- BBV-1374541891
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.24
- Heavy atoms count
- 13
- Rotatable bond count
- 2
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.2
- Polar surface area (Å)
- 26
- Hydrogen bond acceptors count
- 1
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB20523294007
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