Basic information
- CAS
16063-16-4- Standard SMILES
Cn1cc(S(C)=O)c(=O)c2ccccc21- InChIKey
UZWAHQKAIZUPJV-UHFFFAOYSA-N- Molecular formula
- C11H11NO2S
- Average molar mass
- 221.28 g/mol
- Monoisotopic mass
- 221.05104977
Names & identifiers
- Preferred name
- 3-(Methanesulfinyl)-1-methylquinolin-4(1H)-one
- IUPAC
- 1-methyl-3-methylsulfinylquinolin-4-one
Names & synonyms
16063-16-4DTXSID803130093-(Methanesulfinyl)-1-methylquinolin-4(1H)-oneRefChem:275636DTXCID30264133NSC265520SCHEMBL6050620NSC-265520
Database identifiers
- CAS
16063-16-4- PubChem CID
- 319869
- DTXSID
DTXSID80313009- Nikkaji
- J1.206.086F
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 56.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 337
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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