Structure Info
- Chemspace ID
- CSSS00159433061 (In-Stock Screening Compounds)
- IUPAC Name
- 2-(4-chlorophenyl)-4-hydroxy-7,7-dimethyl-5-oxo-1,5,6,7,8,8a-hexahydronaphthalene-1,1-dicarbonitrile
- Mol formula
- C20H17ClN2O2
- Mol weight
- 353 Da
- Catalog Number(s)
- 5521483, CSC159433061
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.35
- Heavy atoms count
- 25
- Rotatable bond count
- 1
- Number of rings
- 3
- Carbon bond saturation, Fsp3
- 0.35
- Polar surface area (Å)
- 85
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSSS00159433061
Items Overall 1 item from 1 supplier
Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
---|---|---|---|---|---|---|
ChemBridge Corp. | 14 days | United States To: | 90 | 1 mg | 68 | |
Description: Name: 2-(4-chlorophenyl)-4-hydroxy-7,7-dimethyl-5-oxo-6,7,8,8a-tetrahydro-1,1(5H)-naphthalenedicarbonitrile; Stereochemistry: unknown; Compound state: solid |
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