Structure Info
- Chemspace ID
- CSMB02142818524 (Enamine MADE)
- IUPAC Name
- methyl [(3-ethynylphenyl)(methyl)carbamoyl]formate
- Mol formula
- C12H11NO3
- Mol weight
- 217 Da
- Catalog Number(s)
- BBV-204318305
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.56
- Heavy atoms count
- 16
- Rotatable bond count
- 3
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.166
- Polar surface area (Å)
- 47
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB02142818524
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