7-chloro-10-methyl-3,5,12-trioxatricyclo[7.3.0.0²,⁶]dodeca-1(9),2(6),7-triene-10-carbonitrile
Structure Info
- Chemspace ID
- CSMB20616933830 (Enamine MADE)
- IUPAC Name
- 7-chloro-10-methyl-3,5,12-trioxatricyclo[7.3.0.0²,⁶]dodeca-1(9),2(6),7-triene-10-carbonitrile
- Mol formula
- C11H8ClNO3
- Mol weight
- 238 Da
- Catalog Number(s)
- BBV-1484653284
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.08
- Heavy atoms count
- 16
- Rotatable bond count
- 0
- Number of rings
- 3
- Carbon bond saturation, Fsp3
- 0.36363636363636
- Polar surface area (Å)
- 51
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB20616933830
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