Structure Info
- Chemspace ID
- CSMB00012592597 (Enamine MADE)
- CAS
- 6267-25-0
- MFCD
- MFCD21947353, MFCD13175287
- IUPAC Name
- 4-(chloromethoxy)-2-methyl-1-nitrobenzene
- Mol formula
- C8H8ClNO3
- Mol weight
- 202 Da
- Catalog Number(s)
- BBV-41961891, CS-0287341, CSC012592597, EN300-646477, FCH5125086, HY-W224824, JH394933, YJB96877
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.88
- 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
- CSMB00012592597
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