Structure Info
- Chemspace ID
- CSMB00116213255 (Enamine MADE)
- CAS
- 2248267-99-2
- IUPAC Name
- 7-{[(tert-butoxy)carbonyl]amino}-2,3-dihydro-1,4-benzodioxine-6-carboxylic acid
- Mol formula
- C14H17NO6
- Mol weight
- 295 Da
- Catalog Number(s)
- BBV-159230148, CSC116213255, EN300-6508517
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.05
- Heavy atoms count
- 21
- Rotatable bond count
- 4
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.428
- Polar surface area (Å)
- 94
- Hydrogen bond acceptors count
- 6
- Hydrogen bond donors count
- 2
- Zoom the structure
- CSMB00116213255
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