Basic information
- CAS
19199-32-7- Standard SMILES
O=C(C=Cc1ccc(Cl)cc1)N1CCCC1- InChIKey
JPBLTINKPAYBRJ-UHFFFAOYSA-N- Molecular formula
- C13H14ClNO
- Average molar mass
- 235.71 g/mol
- Monoisotopic mass
- 235.0763918
Names & identifiers
- Preferred name
- Pyrrolidine, 1-[3-(4-chlorophenyl)-1-oxo-2-propenyl]-
- IUPAC
- 3-(4-chlorophenyl)-1-pyrrolidin-1-ylprop-2-en-1-one
Names & synonyms
19199-32-7Pyrrolidine, 1-[3-(4-chlorophenyl)-1-oxo-2-propenyl]-DTXSID20355625AKOS0341604973-(4-chlorophenyl)-1-(pyrrolidin-1-yl)prop-2-en-1-one
Database identifiers
- CAS
19199-32-7- PubChem CID
- 809694
- DTXSID
DTXSID20355625
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 263
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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