Structure Info
- Chemspace ID
- CSCS00021283667 (Synthesis)
- IUPAC Name
- 1-(chloromethyl)-5-methoxy-3-methyl-2-nitrobenzene
- Mol formula
- C9H10ClNO3
- Mol weight
- 216 Da
- Catalog Number(s)
- BBV-107552696, CSC021283667, FCH7997204
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.86
- Heavy atoms count
- 14
- Rotatable bond count
- 3
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.333
- Polar surface area (Å)
- 52
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSCS00021283667
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