CHEBI:193992 - 5-Nitro-2-propoxyaniline

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 5-Nitro-2-propoxyaniline
ChEBI ID CHEBI:193992
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C9H12N2O3
Net Charge 0
Average Mass 196.206
Monoisotopic Mass 196.08479
InChI InChI=1S/C9H12N2O3/c1-2-5-14-9-4-3-7(11(12)13)6-8(9)10/h3-4,6H,2,5,10H2,1H3
InChIKey RXQCEGOUSFBKPI-UHFFFAOYSA-N
SMILES O(CCC)C1=C(N)C=C([N+]([O-])=O)C=C1
Metabolite of Species Details
mock community culture Found in Whole Organism (NCIT:C13413). See: MetaboLights Study
ChEBI Ontology
Outgoing 5-Nitro-2-propoxyaniline (CHEBI:193992) is a C-nitro compound (CHEBI:35716)
5-Nitro-2-propoxyaniline (CHEBI:193992) is a aromatic ether (CHEBI:35618)
IUPAC Name
5-nitro-2-propoxyaniline
Manual Xrefs Databases
10647 ChemSpider
HMDB0037688 HMDB
View more database links
Registry Number Type Source
553-79-7 CAS Registry Number ChemIDplus