Structure Info
- Chemspace ID
- CSMB00000025213 (Enamine MADE)
- MFCD
- MFCD17015563
- IUPAC Name
- 4-ethoxy-2-methyl-1-nitrobenzene
- Mol formula
- C9H11NO3
- Mol weight
- 181 Da
- Catalog Number(s)
- A019092375, AD246630, AG257867, AP36575, BBV-39684814, BD561968, CD12065509, CS-0666632, CSC000025213, CSCR00000271945, F553278, FCH1113924, G82594, JH322321, PV-002502985474, Y4185356, Z225881928, s_7_101978_5047, s_7____101978____5047
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.63
- Heavy atoms count
- 13
- 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
- CSMB00000025213
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