Basic information
- CAS
73826-51-4- Standard SMILES
CC(C)Oc1ccc(C(=O)CCN2CCCC2)cc1.Cl- InChIKey
ISROOWCDEAJJFO-UHFFFAOYSA-N- Molecular formula
- C16H24ClNO2
- Average molar mass
- 297.82 g/mol
- Monoisotopic mass
- 297.1495567
Names & identifiers
- Preferred name
- Propiophenone, 4'-isopropoxy-3-pyrrolidinyl-, hydrochloride
- IUPAC
- 1-(4-propan-2-yloxyphenyl)-3-pyrrolidin-1-ylpropan-1-one;hydrochloride
Names & synonyms
Propiophenone, 4'-isopropoxy-3-pyrrolidinyl-, hydrochloride4'-Isopropoxy-3-pyrrolidinylpropiophenone hydrochloride73826-51-4DTXSID80224323RefChem:375479DTXCID801468141-{4-[(Propan-2-yl)oxy]phenyl}-3-(pyrrolidin-1-yl)propan-1-one--hydrogen chloride (1/1)
Database identifiers
- CAS
73826-51-4- PubChem CID
- 3056757
- DTXSID
DTXSID80224323
Properties
Computed structural properties
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 276
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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