Basic information
- CAS
40493-21-8- Standard SMILES
CC1(C)CCCN1CC(C(=O)c1ccccc1)c1ccccc1.Cl- InChIKey
JJCLUKWQCSNXSQ-UHFFFAOYSA-N- Molecular formula
- C21H26ClNO
- Average molar mass
- 343.9 g/mol
- Monoisotopic mass
- 343.1702921
Names & identifiers
- Preferred name
- 3-(2,2-Dimethylpyrrolidin-1-yl)-1,2-diphenylpropan-1-one--hydrogen chloride (1/1)
- IUPAC
- 3-(2,2-dimethylpyrrolidin-1-yl)-1,2-diphenylpropan-1-one;hydrochloride
Names & synonyms
40493-21-8DTXSID609608733-(2,2-Dimethylpyrrolidin-1-yl)-1,2-diphenylpropan-1-one--hydrogen chloride (1/1)RefChem:1066419DTXCID2013887143-(1-(2,2-Dimethyl)pyrrolidinyl)-2-phenylpropiophenone hydrochloridePropiophenone, 3-(1-(2,2-dimethyl)pyrrolidinyl)-2-phenyl-, hydrochloride
Database identifiers
- CAS
40493-21-8- PubChem CID
- 218327
- DTXSID
DTXSID60960873
Properties
Computed structural properties
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 391
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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