Structure Info
- Chemspace ID
- CSMB00114098058 (Enamine MADE)
- IUPAC Name
- [(2-bromo-4-fluoro-5-methylphenyl)methyl](methyl)amine
- Mol formula
- C9H11BrFN
- Mol weight
- 232 Da
- Catalog Number(s)
- BBV-149120746, CSC1069886849, CSC114098058, CSCR01069886849, EN300-37032393, PV-004898829500, Z2697255513, s_207_134027_12346130, s_207____134027____12346130
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.96
- Heavy atoms count
- 12
- Rotatable bond count
- 2
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.333
- Polar surface area (Å)
- 12
- Hydrogen bond acceptors count
- 1
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00114098058
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