Structure Info
- Chemspace ID
- CSMB00021849518 (Enamine MADE)
- IUPAC Name
- methyl 3-[(3-chloroprop-2-en-1-yl)amino]-4-fluorobenzoate
- Mol formula
- C11H11ClFNO2
- Mol weight
- 244 Da
- Catalog Number(s)
- BBV-48131817, CSC021849518, CSCR00006207339, Z1446774355
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.64
- Heavy atoms count
- 16
- Rotatable bond count
- 5
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.181
- Polar surface area (Å)
- 38
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00021849518
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