2-(Methoxymethyl)-5,7-dimethyl-4(1H)-quinolinone
Basic information
- CAS
1249987-63-0- Standard SMILES
COCc1cc(=O)c2c(C)cc(C)cc2[nH]1- InChIKey
BBBJVGYUMBCCNK-UHFFFAOYSA-N- Molecular formula
- C13H15NO2
- Average molar mass
- 217.26 g/mol
- Monoisotopic mass
- 217.11027872
Names & identifiers
- Preferred name
- 2-(Methoxymethyl)-5,7-dimethyl-4(1H)-quinolinone
- IUPAC
- 2-(methoxymethyl)-5,7-dimethyl-1H-quinolin-4-one
Names & synonyms
DTXSID401237375AKOS0116030472-(Methoxymethyl)-5,7-dimethyl-4(1H)-quinolinone2-(Methoxymethyl)-5,7-dimethylquinolin-4(1H)-one1249987-63-0
Database identifiers
- CAS
1249987-63-0- PubChem CID
- 62318993
- DTXSID
DTXSID401237375
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 311
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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