Basic information
- CAS
79378-15-7- Standard SMILES
O=C(CN1CCOCC1)c1ccc([N+](=O)[O-])cc1- InChIKey
RIDJIJUABGPIDB-UHFFFAOYSA-N- Molecular formula
- C12H14N2O4
- Average molar mass
- 250.25 g/mol
- Monoisotopic mass
- 250.09535693
Names & identifiers
- Preferred name
- 2-Morpholin-4-yl-1-(4-nitrophenyl)ethanone
- IUPAC
- 2-morpholin-4-yl-1-(4-nitrophenyl)ethanone
Names & synonyms
79378-15-72-morpholin-4-yl-1-(4-nitrophenyl)ethanoneNSC236262-morpholin-4-yl-1-(4-nitro-phenyl)-ethanoneSCHEMBL4039612RIDJIJUABGPIDB-UHFFFAOYSA-NDTXSID301000432NSC-23626AKOS0059003161-(4-nitrophenyl)-2-morpholinylethanone2-(Morpholin-4-yl)-1-(4-nitrophenyl)ethan-1-one
Database identifiers
- CAS
79378-15-7- PubChem CID
- 229745
- DTXSID
DTXSID301000432
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 75.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 302
Related reactions
7 records
Compound notes
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