Structure Info
- Chemspace ID
- CSMB03567495291 (Enamine MADE)
- IUPAC Name
- methyl 7-amino-2-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxine-6-carboxylate
- Mol formula
- C11H13NO5
- Mol weight
- 239 Da
- Catalog Number(s)
- BBV-413197297
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 0.68
- Heavy atoms count
- 17
- Rotatable bond count
- 3
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.363
- Polar surface area (Å)
- 91
- Hydrogen bond acceptors count
- 5
- Hydrogen bond donors count
- 2
- Zoom the structure
- CSMB03567495291
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