Structure Info
- Chemspace ID
- CSMB03567426799 (Enamine MADE)
- IUPAC Name
- methyl 6-amino-2-cyano-3,4-dimethoxybenzoate
- Mol formula
- C11H12N2O4
- Mol weight
- 236 Da
- Catalog Number(s)
- BBV-413048893
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.34
- Heavy atoms count
- 17
- Rotatable bond count
- 4
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.272
- Polar surface area (Å)
- 95
- Hydrogen bond acceptors count
- 5
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB03567426799
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