Structure Info
- Chemspace ID
- CSMB00009857902 (Enamine MADE)
- CAS
- 69111-47-3
- MFCD
- MFCD12756725
- IUPAC Name
- 2-(5-methoxy-2-nitrophenyl)acetaldehyde
- Mol formula
- C9H9NO4
- Mol weight
- 195 Da
- Catalog Number(s)
- BBV-39739805, CSC009857902, EN300-1866814, FCH1155067, IMED1255485319
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.23
- Heavy atoms count
- 14
- Rotatable bond count
- 4
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.222
- Polar surface area (Å)
- 69
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB00009857902
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