Propiophenone, 3-morpholino-4'-nitro-, monohydrochloride
Basic information
- CAS
1507-06-8- Standard SMILES
Cl.O=C(CCN1CCOCC1)c1ccc([N+](=O)[O-])cc1- InChIKey
UGFWUIDXNJQPCQ-UHFFFAOYSA-N- Molecular formula
- C13H17ClN2O4
- Average molar mass
- 300.74 g/mol
- Monoisotopic mass
- 300.0876847
Names & identifiers
- Preferred name
- Propiophenone, 3-morpholino-4'-nitro-, monohydrochloride
- IUPAC
- 3-morpholin-4-yl-1-(4-nitrophenyl)propan-1-one;hydrochloride
Names & synonyms
NSC 12476Propiophenone, 3-morpholino-4'-nitro-, monohydrochloride1507-06-83-Morpholino-4'-nitro-propiophenone hydrochlorideDTXSID40164594RefChem:375389DTXCID9087085CHEMBL555763SCHEMBL7930353NSC12476NSC-124763-(Morpholin-4-yl)-1-(4-nitrophenyl)propan-1-one--hydrogen chloride (1/1)
Database identifiers
- CAS
1507-06-8- PubChem CID
- 200302
- DTXSID
DTXSID40164594- ChEMBL
CHEMBL555763
Properties
Computed structural properties
- Topological polar surface area
- 75.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 315
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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