CHEBI:67123 - 1-iodo-3-nitrobenzene

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ChEBI Name 1-iodo-3-nitrobenzene ChEBI ID CHEBI:67123 Definition A C-nitro compound that is nitrobenzene bearing an iodine substituent at C-3. Stars This entity has been manually annotated by the ChEBI Team. 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 C6H4INO2 Net Charge 0 Average Mass 249.00590 Monoisotopic Mass 248.92867 InChI InChI=1S/C6H4INO2/c7-5-2-1-3-6(4-5)8(9)10/h1-4H InChIKey CBYAZOKPJYBCHE-UHFFFAOYSA-N SMILES [O-][N+](=O)c1cccc(I)c1 ChEBI Ontology Outgoing 1-iodo-3-nitrobenzene (CHEBI:67123) is a C-nitro compound (CHEBI:35716) 1-iodo-3-nitrobenzene (CHEBI:67123) is a organoiodine compound (CHEBI:37142) IUPAC Name 1-iodo-3-nitrobenzene Synonyms Sources 3-I-nitrobenzene ChEBI 3-Iodonitrobenzene ChemIDplus 3-nitroiodobenzene ChEBI iodo-3-nitrobenzene ChEBI m-Iodonitrobenzene ChemIDplus meta-iodonitrobenzene ChEBI meta-nitroiodobenzene ChEBI Registry Numbers Types Sources 1525167 Reaxys Registry Number Reaxys 645-00-1 CAS Registry Number NIST Chemistry WebBook 645-00-1 CAS Registry Number ChemIDplus Citations Types Sources 12175237 PubMed citation Europe PMC 1650428 PubMed citation Europe PMC Last Modified 11 March 2014