Structure Info
- Chemspace ID
- CSMB00012962275 (Enamine MADE)
- MFCD
- MFCD24150743
- IUPAC Name
- [(2-bromo-3-methylphenyl)carbamoyl]formic acid
- Mol formula
- C9H8BrNO3
- Mol weight
- 258 Da
- Catalog Number(s)
- BBV-44874823, CSC012962275, IMED1470767491
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.45
- Heavy atoms count
- 14
- Rotatable bond count
- 2
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.111
- Polar surface area (Å)
- 66
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 2
- Zoom the structure
- CSMB00012962275
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