CHEBI:66891 - 5-nitro-o-toluidine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 5-nitro-o-toluidine
ChEBI ID CHEBI:66891
ChEBI ASCII Name 5-nitro-o-toluidine
Definition A C-nitro compound in which the nitro compound is meta to the amino group and para to the methyl group of o-toluidine.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information ChemicalBook:CB5689132, eMolecules:477686, ZINC000006827723
Download Molfile XML SDF
Formula C7H8N2O2
Net Charge 0
Average Mass 152.15060
Monoisotopic Mass 152.05858
InChI InChI=1S/C7H8N2O2/c1-5-2-3-6(9(10)11)4-7(5)8/h2-4H,8H2,1H3
InChIKey DSBIJCMXAIKKKI-UHFFFAOYSA-N
SMILES Cc1ccc(cc1N)[N+]([O-])=O
ChEBI Ontology
Outgoing 5-nitro-o-toluidine (CHEBI:66891) has functional parent o-toluidine (CHEBI:66892)
5-nitro-o-toluidine (CHEBI:66891) is a C-nitro compound (CHEBI:35716)
IUPAC Name
2-methyl-5-nitroaniline
Synonyms Sources
1-Amino-2-methyl-5-nitrobenzene ChemIDplus
2-Amino-4-nitrotoluene ChemIDplus
2-Methyl-5-nitro-benzeneamine ChemIDplus
2-Methyl-5-nitrobenzenamine ChemIDplus
3-Nitro-6-methylaniline ChemIDplus
4-Nitro-2-aminotoluene ChemIDplus
5-Nitro-2-methylaniline ChemIDplus
5-Nitro-2-toluidine ChemIDplus
5-Nitro-o-toluidine KEGG COMPOUND
6-Methyl-3-nitroaniline ChemIDplus
o-amino-p-nitrotoluene ChEBI
Manual Xref Database
C16398 KEGG COMPOUND
View more database links
Registry Numbers Types Sources
879021 Reaxys Registry Number Reaxys
99-55-8 CAS Registry Number ChemIDplus
99-55-8 CAS Registry Number NIST Chemistry WebBook
Citation Type Source
1650428 PubMed citation Europe PMC
Last Modified
28 July 2014