Structure Info
- Chemspace ID
- CSMB00010362877 (Enamine MADE)
- CAS
- 1337769-61-5
- MFCD
- MFCD22121329
- IUPAC Name
- 1-(5-methoxy-2-nitrophenyl)ethan-1-amine
- Mol formula
- C9H12N2O3
- Mol weight
- 196 Da
- Catalog Number(s)
- BBV-43556068, CSC010362877, EN300-1845221, FCH1599674, IMED3242455286
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.3
- Heavy atoms count
- 14
- Rotatable bond count
- 3
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.333
- Polar surface area (Å)
- 78
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00010362877
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