Structure Info
- Chemspace ID
- CSMB00010150586 (Enamine MADE)
- CAS
- 161230-37-1
- MFCD
- MFCD18398387, MFCD21098386
- IUPAC Name
- 2-(chloromethyl)-4-methoxy-1-nitrobenzene
- Mol formula
- C8H8ClNO3
- Mol weight
- 202 Da
- Catalog Number(s)
- A013010473, AG264003, BBV-40248666, BD587302, CD12136551, CSC010150586, EN300-1983550, FCH1372559, IMED3245004151, SAB-106278, SEA88416
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.34
- Heavy atoms count
- 13
- Rotatable bond count
- 3
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.25
- Polar surface area (Å)
- 52
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB00010150586
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