4-acetyl-1H-quinolin-2-one
Basic information
- CAS
16511-39-0- Standard SMILES
CC(=O)c1cc(=O)[nH]c2ccccc12- InChIKey
TVAHXHRNSSBFSY-UHFFFAOYSA-N- Molecular formula
- C11H9NO2
- Average molar mass
- 187.19 g/mol
- Monoisotopic mass
- 187.06332853
Names & identifiers
- Preferred name
- 4-acetyl-1H-quinolin-2-one
- IUPAC
- 4-acetyl-1H-quinolin-2-one
- English name
- 4-ACETYL-2(1H)-QUINOLINONE
- Molecular formula
- C11H9NO2
- Molecular weight
- 187.19
Names & synonyms
4-acetyl-1H-quinolin-2-one4-acetylquinolin-2(1h)-oneCarbostyril, 4-acetyl-2(1H)-Quinolinone, 4-acetyl-4-Acetyl-2-quinolinoneSCHEMBL102020384-Acetyl-2(1H)-quinolinone #DTXSID70345435TVAHXHRNSSBFSY-UHFFFAOYSA-N4-ACETYL-2(1H)-QUINOLINONE
Database identifiers
- CAS
16511-39-0- PubChem CID
- 604487
- DTXSID
DTXSID70345435- Nikkaji
- J103.758G
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 46.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 306
Physicochemical properties
- Melting point
- 194 · 194-195 °C
- Boiling point
- 436.6 · 436.6±45.0 °C(Predicted)
- Density
- 1.236 · 1.236±0.06 g/cm3(Predicted)
- pka
- 10.86 · 10.86±0.70(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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