Basic information
- CAS
31684-10-3- Standard SMILES
CC(C)NC(C)C(=O)c1ccco1.Cl- InChIKey
NEVDJWAYSTXBFC-UHFFFAOYSA-N- Molecular formula
- C10H16ClNO2
- Average molar mass
- 217.69 g/mol
- Monoisotopic mass
- 217.0869564
Names & identifiers
- Preferred name
- 1-Propanone, 1-(2-furyl)-2-(isopropylamino)-, hydrochloride
- IUPAC
- 1-(furan-2-yl)-2-(propan-2-ylamino)propan-1-one;hydrochloride
Names & synonyms
1-(2-Furyl)-2-(isopropylamino)-1-propanone hydrochloride31684-10-3(Furyl-2)(alpha-isopropylamino-ethyl)ketone hydrochloride1-Propanone, 1-(2-furyl)-2-(isopropylamino)-, hydrochlorideRefChem:234765DTXSID709536351-(Furan-2-yl)-2-[(propan-2-yl)amino]propan-1-one--hydrogen chloride (1/1)
Database identifiers
- CAS
31684-10-3- PubChem CID
- 208136
- DTXSID
DTXSID70953635
Properties
Computed structural properties
- Topological polar surface area
- 42.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 180
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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