Basic information
- CAS
31349-74-3- Standard SMILES
O=C(c1ccc(OCCN2CCCC2)cc1)C(Cc1ccc(Cl)cc1)c1ccccc1- InChIKey
DJDIBBAHRRXHLO-UHFFFAOYSA-N- Molecular formula
- C27H28ClNO2
- Average molar mass
- 434 g/mol
- Monoisotopic mass
- 433.1808568
Names & identifiers
- Preferred name
- 3-(p-Chlorophenyl)-2-phenyl-4'-(2-(1-pyrrolidinyl)ethoxy)propiophenone
- IUPAC
- 3-(4-chlorophenyl)-2-phenyl-1-[4-(2-pyrrolidin-1-ylethoxy)phenyl]propan-1-one
- English name
- β-(p-Chlorophenyl)-α-phenyl-4'-[2-(1-pyrrolidinyl)ethoxy]propiophenone
- Molecular formula
- C27H28ClNO2
- Molecular weight
- 433.97
Names & synonyms
31349-74-33-(p-Chlorophenyl)-2-phenyl-4'-(2-(1-pyrrolidinyl)ethoxy)propiophenone3-(4-chlorophenyl)-2-phenyl-1-[4-(2-pyrrolidin-1-ylethoxy)phenyl]propan-1-one3-(4-chlorophenyl)-2-phenyl-1-{4-[2-(pyrrolidin-1-yl)ethoxy]phenyl}propan-1-onePropiophenone, 3-(p-chlorophenyl)-2-phenyl-4'-(2-(1-pyrrolidinyl)ethoxy)-DTXSID50953390beta-(p-Chlorophenyl)-alpha-phenyl-4'-[2-(1-pyrrolidinyl)ethoxy]propiophenoneβ-(p-Chlorophenyl)-α-phenyl-4'-[2-(1-pyrrolidinyl)ethoxy]propiophenone1-Propanone, 3-(4-chlorophenyl)-2-phenyl-1-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]-
Database identifiers
- CAS
31349-74-3- PubChem CID
- 207995
- DTXSID
DTXSID50953390- Nikkaji
- J71.067I
Properties
Computed structural properties
- XLogP
- 6.3
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 9
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 527
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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