Basic information
- CAS
20809-17-0- Standard SMILES
CCCC(=O)c1ccc(OCC[NH+](CC)CC)cc1O.[Cl-]- InChIKey
GVKWVEPDWCXITD-UHFFFAOYSA-N- Molecular formula
- C16H26ClNO3
- Average molar mass
- 315.83 g/mol
- Monoisotopic mass
- 315.1601214
Names & identifiers
- Preferred name
- Butyrophenone, 4'-(2-(diethylamino)ethoxy)-2'-hydroxy-, hydrochloride
- IUPAC
- 2-(4-butanoyl-3-hydroxyphenoxy)ethyl-diethylazanium chloride
Names & synonyms
Butyrophenone, 4'-(2-(diethylamino)ethoxy)-6'-hydroxy-, hydrochloride4-Butyryl-3-hydroxy-beta-(N,N-diethyl)phenoxyethylamine, hydrochlorideBUTYROPHENONE, 4'-(2-(DIETHYLAMINO)ETHOXY)-2'-HYDROXY-, HYDROCHLORIDE20809-17-0RefChem:331385
Database identifiers
- CAS
20809-17-0- PubChem CID
- 30296
Properties
Computed structural properties
- Topological polar surface area
- 51 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 279
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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