Structure Info
- Chemspace ID
- CSMB00103008241 (Enamine MADE)
- CAS
- 2227822-27-5
- IUPAC Name
- (2S)-4-(5-methoxy-2-nitrophenyl)butan-2-ol
- Mol formula
- C11H15NO4
- Mol weight
- 225 Da
- Catalog Number(s)
- BBV-137208239, CSC103008241, EN300-1789650, IMED3271460583
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.14
- Heavy atoms count
- 16
- Rotatable bond count
- 5
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.454
- Polar surface area (Å)
- 73
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00103008241
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