Structure Info
- Chemspace ID
- CSMB01991136161 (Enamine MADE)
- IUPAC Name
- cyanomethyl 3-methoxy-1-methyl-1H-pyrazole-4-carboxylate
- Mol formula
- C8H9N3O3
- Mol weight
- 195 Da
- Catalog Number(s)
- BBV-932309807, CSCR00000736170, Z2923348407, s_1458_13188264_483934, s_1458____13188264____483934
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 0.38
- Heavy atoms count
- 14
- Rotatable bond count
- 4
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.375
- Polar surface area (Å)
- 77
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB01991136161
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