Basic information
- CAS
63990-83-0- Standard SMILES
CC(=O)c1cccc(OCC(O)C[NH2+]CCc2ccccc2)c1.[Cl-]- InChIKey
FFEYDPUBDJREFF-UHFFFAOYSA-N- Molecular formula
- C19H24ClNO3
- Average molar mass
- 349.8 g/mol
- Monoisotopic mass
- 349.1444713
Names & identifiers
- Preferred name
- Acetophenone, 3'-((2-hydroxy-3-phenethylamino)propoxy)-, hydrochloride
- IUPAC
- [3-(3-acetylphenoxy)-2-hydroxypropyl]-(2-phenylethyl)azanium chloride
Names & synonyms
3'-((2-Hydroxy-3-phenethylamino)propoxy)acetophenone hydrochloride63990-83-0ACETOPHENONE, 3'-((2-HYDROXY-3-PHENETHYLAMINO)PROPOXY)-, HYDROCHLORIDERefChem:316931
Database identifiers
- CAS
63990-83-0- PubChem CID
- 46200
Properties
Computed structural properties
- Topological polar surface area
- 63.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 342
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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