Structure Info
- Chemspace ID
- CSMB00133540926 (Enamine MADE)
- IUPAC Name
- methyl 2-(2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-6-yl)-2-oxoacetate
- Mol formula
- C14H16O4
- Mol weight
- 248 Da
- Catalog Number(s)
- BBV-160589667, CSC133540926
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.89
- Heavy atoms count
- 18
- Rotatable bond count
- 3
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.428
- Polar surface area (Å)
- 53
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB00133540926
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