Structure Info
- Chemspace ID
- CSCS00053616951 (Synthesis)
- IUPAC Name
- (3R,6R,7S,9R)-1-ethyl-5-oxo-4-oxatricyclo[4.2.1.0³,⁷]nonane-9-carboxylic acid
- Mol formula
- C11H14O4
- Mol weight
- 210 Da
- Catalog Number(s)
- BBV-78343124, CSC053616951, FCH4002338
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 0.88
- Heavy atoms count
- 15
- Rotatable bond count
- 2
- Number of rings
- 3
- Carbon bond saturation, Fsp3
- 0.818
- Polar surface area (Å)
- 64
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSCS00053616951
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