Basic information
- CAS
20800-12-8- Standard SMILES
CCCC(=O)c1ccc(OCC[NH+]2CCOCC2)cc1O.[Cl-]- InChIKey
YASHSIVCBSKXML-UHFFFAOYSA-N- Molecular formula
- C16H24ClNO4
- Average molar mass
- 329.82 g/mol
- Monoisotopic mass
- 329.1393859
Names & identifiers
- Preferred name
- Butyrophenone, 2'-hydroxy-4'-(2-morpholinoethoxy)-, hydrochloride
- IUPAC
- 1-[2-hydroxy-4-(2-morpholin-4-ium-4-ylethoxy)phenyl]butan-1-one chloride
Names & synonyms
BUTYROPHENONE, 2'-HYDROXY-4'-(2-MORPHOLINOETHOXY)-, HYDROCHLORIDE20800-12-82'-Hydroxy-4'-(2-(morpholino)ethoxy)butyrophenone hydrochlorideButyrophenone, 6'-hydroxy-4'-(2-morpholinoethoxy)-, hydrochlorideRefChem:331371
Database identifiers
- CAS
20800-12-8- PubChem CID
- 30259
Properties
Computed structural properties
- Topological polar surface area
- 60.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 317
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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