Basic information
- CAS
110229-46-4- Standard SMILES
Cn1c(=O)c(Cc2ccccc2)cc2ccccc21- InChIKey
KWABMRZWYYTMOZ-UHFFFAOYSA-N- Molecular formula
- C17H15NO
- Average molar mass
- 249.31 g/mol
- Monoisotopic mass
- 249.1153641
Names & identifiers
- Preferred name
- 3-Benzyl-1-methylquinolin-2(1H)-one
- IUPAC
- 3-benzyl-1-methylquinolin-2-one
Names & synonyms
3-Benzyl-1-methylquinolin-2(1H)-one110229-46-4DTXSID60547188RefChem:276985DTXCID60497972
Database identifiers
- CAS
110229-46-4- PubChem CID
- 13704652
- DTXSID
DTXSID60547188- Nikkaji
- J3.438.071F
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 367
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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