Basic information
- CAS
53761-45-8- Standard SMILES
CCn1c(=O)ccc2cc(C)ccc21- InChIKey
DIVRPKANRVIGAX-UHFFFAOYSA-N- Molecular formula
- C12H13NO
- Average molar mass
- 187.24 g/mol
- Monoisotopic mass
- 187.09971404
Names & identifiers
- Preferred name
- 2(1H)-Quinolinone, 1-ethyl-6-methyl-
- IUPAC
- 1-ethyl-6-methylquinolin-2-one
- English name
- 1-Ethyl-6-methyl-2(1H)-quinolinone
- Molecular formula
- C12H13NO
- Molecular weight
- 187.24
Names & synonyms
2(1H)-Quinolinone, 1-ethyl-6-methyl-1-Ethyl-6-methyl-2(1H)-quinolinoneN-Ethyl-6-methyl-2-quinoloneDTXSID9068879RefChem:80457DTXCID104150053761-45-81-ethyl-6-methylquinolin-2(1h)-oneSCHEMBL9310207DIVRPKANRVIGAX-UHFFFAOYSA-NDB-312165
Database identifiers
- CAS
53761-45-8- PubChem CID
- 104602
- DTXSID
DTXSID9068879- Nikkaji
- J39.114J
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 259
Physicochemical properties
- EWG's Food Scores
- 1 · 1
- EPA Substance Registry System
- 2 · 2(1H)-Quinolinone, 1-ethyl-6-methyl- (53761-45-8)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information2(1H)-Quinolinone, 1-ethyl-6-methyl-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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