Structure Info
- Chemspace ID
- CSMB00021104654 (Enamine MADE)
- IUPAC Name
- methyl 7-amino-8-methyl-2,3-dihydro-1,4-benzodioxine-6-carboxylate
- Mol formula
- C11H13NO4
- Mol weight
- 223 Da
- Catalog Number(s)
- BBV-95705321, CSC021104654, FCH6829552
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.82
- Heavy atoms count
- 16
- Rotatable bond count
- 2
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.363
- Polar surface area (Å)
- 71
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00021104654
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