Basic information
- CAS
68231-98-1- Standard SMILES
O=C1Cn2c(cc(=O)c3ccccc32)O1- InChIKey
PWSWKWNDGWYMNL-UHFFFAOYSA-N- Molecular formula
- C11H7NO3
- Average molar mass
- 201.18 g/mol
- Monoisotopic mass
- 201.04259309
Names & identifiers
- Preferred name
- 5H-(1,3)Oxazolo(3,2-a)quinoline-2,5(1H)-dione
- IUPAC
- 1H-[1,3]oxazolo[3,2-a]quinoline-2,5-dione
Names & synonyms
68231-98-15H-(1,3)Oxazolo(3,2-a)quinoline-2,5(1H)-dioneNSC 353091DTXSID802184045H-[1,3]Oxazolo[3,2-a]quinoline-2,5(1H)-dioneRefChem:305141DTXCID60140895NSC353091NSC-3530911H-oxazolo[3,2-a]quinoline-2,5-dione
Database identifiers
- CAS
68231-98-1- PubChem CID
- 336907
- DTXSID
DTXSID80218404
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 46.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 361
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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