Structure Info
- Chemspace ID
- CSCS00010133786 (Synthesis)
- MFCD
- MFCD18208917
- IUPAC Name
- 4,5-dihydroxy-7-nitro-2,3-dihydro-1H-inden-1-one
- Mol formula
- C9H7NO5
- Mol weight
- 209 Da
- Catalog Number(s)
- BBV-45147497, CSC010133786, FCH1720742
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.17
- Heavy atoms count
- 15
- Rotatable bond count
- 1
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.22222222222222
- Polar surface area (Å)
- 101
- Hydrogen bond acceptors count
- 5
- Hydrogen bond donors count
- 2
- Zoom the structure
- CSCS00010133786
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