Structure Info
- Chemspace ID
- CSMB00041154701 (Enamine MADE)
- IUPAC Name
- 7-amino-5-methyl-2,3-dihydro-1,4-benzodioxine-6-carboxylic acid
- Mol formula
- C10H11NO4
- Mol weight
- 209 Da
- Catalog Number(s)
- BBV-95370186, CSC041154701, FCH6463739
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.48
- Heavy atoms count
- 15
- Rotatable bond count
- 1
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.3
- Polar surface area (Å)
- 82
- Hydrogen bond acceptors count
- 5
- Hydrogen bond donors count
- 2
- Zoom the structure
- CSMB00041154701
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