Structure Info
- Chemspace ID
- CSMB00102997575 (Enamine MADE)
- CAS
- 2228582-96-3
- IUPAC Name
- 3-[2-(methylamino)propan-2-yl]benzonitrile
- Mol formula
- C11H14N2
- Mol weight
- 174 Da
- Catalog Number(s)
- BBV-137197524, CSC102997575, EN300-1776316, IMED2602495389, PV-009798582037, s_2230_11952350_2463448, s_2230____11952350____2463448
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.08
- Heavy atoms count
- 13
- Rotatable bond count
- 2
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.36363636363636
- Polar surface area (Å)
- 36
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00102997575
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