Structure Info
- Chemspace ID
- CSMB00155576811 (Enamine MADE)
- IUPAC Name
- propan-2-yl 3-methoxy-1-methyl-1H-pyrazole-4-carboxylate
- Mol formula
- C9H14N2O3
- Mol weight
- 198 Da
- Catalog Number(s)
- BBV-186175740, CSC155576811, CSCR00000891090, PV-002732237322, s_1458_13188264_483920, s_1458____13188264____483920, s_276436____14076930____14107998
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.61
- Heavy atoms count
- 14
- Rotatable bond count
- 4
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.55555555555556
- Polar surface area (Å)
- 53
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB00155576811
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