Structure Info
- Chemspace ID
- CSMB01993927126 (Enamine MADE)
- IUPAC Name
- carbamoylmethyl 2,3,6-trifluorobenzoate
- Mol formula
- C9H6F3NO3
- Mol weight
- 233 Da
- Catalog Number(s)
- BBV-1215758338, CSCR00005452933, Z1725492334, s_1458_8989680_483932, s_1458____8989680____483932
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.08
- Heavy atoms count
- 16
- Rotatable bond count
- 4
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.111
- Polar surface area (Å)
- 69
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB01993927126
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