(6S)-4-Ethyl-6-(4-nitrophenyl)morpholin-3-one
Basic information
- CAS
920798-48-7- Standard SMILES
CCN1C[C@H](c2ccc([N+](=O)[O-])cc2)OCC1=O- InChIKey
USNWXOHSJXJMHO-LLVKDONJSA-N- Molecular formula
- C12H14N2O4
- Average molar mass
- 250.25 g/mol
- Monoisotopic mass
- 250.09535693
Names & identifiers
- Preferred name
- (6S)-4-Ethyl-6-(4-nitrophenyl)morpholin-3-one
- IUPAC
- (6S)-4-ethyl-6-(4-nitrophenyl)morpholin-3-one
Names & synonyms
(6S)-4-Ethyl-6-(4-nitrophenyl)morpholin-3-one920798-48-7SCHEMBL2299007DTXSID60737123
Database identifiers
- CAS
920798-48-7- PubChem CID
- 67354570
- DTXSID
DTXSID60737123
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 75.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 321
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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