CHEBI:28735 - 4-nitroacetophenone

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ChEBI Name 4-nitroacetophenone ChEBI ID CHEBI:28735 Definition A member of the class of acetophenones that is acetophenone substituted at the para-position by a nitro group. Stars This entity has been manually annotated by the ChEBI Team. Secondary ChEBI IDs CHEBI:20454, CHEBI:1908 Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C8H7NO3 Net Charge 0 Average Mass 165.14610 Monoisotopic Mass 165.04259 InChI InChI=1S/C8H7NO3/c1-6(10)7-2-4-8(5-3-7)9(11)12/h2-5H,1H3 InChIKey YQYGPGKTNQNXMH-UHFFFAOYSA-N SMILES CC(=O)c1ccc(cc1)[N+]([O-])=O ChEBI Ontology Outgoing 4-nitroacetophenone (CHEBI:28735) is a C-nitro compound (CHEBI:35716) 4-nitroacetophenone (CHEBI:28735) is a acetophenones (CHEBI:22187) IUPAC Name 1-(4-nitrophenyl)ethanone Synonyms Sources 4'-Nitroacetophenone ChemIDplus 4-Nitroacetophenone KEGG COMPOUND 4-nitrophenylacetoaldehyde ChEBI Methyl-p-nitrophenyl ketone ChemIDplus p-Acetylnitrobenzene ChemIDplus p-Nitroacetophenone KEGG COMPOUND p-Nitrophenyl methyl ketone ChemIDplus Paranitroacetophenone ChemIDplus Manual Xrefs Databases C02803 KEGG COMPOUND CPD-10547 MetaCyc View more database links Registry Numbers Types Sources 100-19-6 CAS Registry Number KEGG COMPOUND 100-19-6 CAS Registry Number ChemIDplus 607777 Reaxys Registry Number Reaxys Citations Types Sources 15112833 PubMed citation Europe PMC 1650428 PubMed citation Europe PMC Last Modified 30 April 2014