Structure Info
- Chemspace ID
- CSMB00000721154 (Enamine MADE)
- CAS
- 1955561-76-8
- MFCD
- MFCD28064144
- IUPAC Name
- 1-[4-(aminomethyl)oxan-4-yl]ethan-1-one hydrochloride
- Mol formula
- C8H16ClNO2
- Mol weight
- 194 Da
- Catalog Number(s)
- BD01019063, CSC000721154, EN300-183926
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- -0.3
- Heavy atoms count
- 12
- Rotatable bond count
- 2
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.875
- Polar surface area (Å)
- 52
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00000721154
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