Structure Info
- Chemspace ID
- CSMB00012961784 (Enamine MADE)
- MFCD
- MFCD22377832
- IUPAC Name
- 1-(5-methoxy-2-nitrophenyl)ethan-1-one
- Mol formula
- C9H9NO4
- Mol weight
- 195 Da
- Catalog Number(s)
- A019137186, BBV-44988475, CSC012961784, G12035, HFC8749, HS-9020, IMED2742179903, JH298538
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.31
- Heavy atoms count
- 14
- Rotatable bond count
- 3
- 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
- CSMB00012961784
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