Structure Info
- Chemspace ID
- CSMB02495424736 (Enamine MADE)
- CAS
- 2173996-45-5
- IUPAC Name
- (1r,4s)-4-[(benzyloxy)methyl]-2-oxabicyclo[2.1.1]hexane-1-carboxylic acid
- Mol formula
- C14H16O4
- Mol weight
- 248 Da
- Catalog Number(s)
- BBV-300879155, EN300-37375182
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.65
- Heavy atoms count
- 18
- Rotatable bond count
- 5
- Number of rings
- 3
- Carbon bond saturation, Fsp3
- 0.5
- Polar surface area (Å)
- 56
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB02495424736
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