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CHEBI:53698 - N-(2,4-dinitrophenyl)aminohexanoic acid

ChEBI IDCHEBI:53698
ChEBI NameN-(2,4-dinitrophenyl)aminohexanoic acid
Stars
ASCII NameN-(2,4-dinitrophenyl)aminohexanoic acid
DefinitionA C-nitro compound comprising hexanoic acid with a (2,4-dinitrophenyl)amino substituent at position C-6.
Last Modified21 January 2014
SubmitterSteve
DownloadsMolfile
FormulaC12H15N3O6
Net Charge0
Average Mass297.267
Monoisotopic Mass297.09609
SMILESO=C(O)CCCCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]
InChIInChI=1S/C12H15N3O6/c16-12(17)4-2-1-3-7-13-10-6-5-9(14(18)19)8-11(10)15(20)21/h5-6,8,13H,1-4,7H2,(H,16,17)
InChIKeyZYUWUKIAUDIXCQ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
N-(2,4-dinitrophenyl)aminohexanoic acid (CHEBI:53698) has functional parent 6-aminohexanoic acid (CHEBI:16586)
N-(2,4-dinitrophenyl)aminohexanoic acid (CHEBI:53698) is a C-nitro compound (CHEBI:35716)
IUPAC Name 
6-[(2,4-dinitrophenyl)amino]hexanoic acid
Synonyms  Source
6-N-(2,4-Dinitrophenyl)aminohexanoic acidChemIDplus
Dnp-aminocaproic acidChemIDplus
Dnp-epsilon-aminocaproateChemIDplus
DNP-CapChEBI
2,4-dinitrophenyl-ε-aminocaproic acidChEBI
6-(2,4-Dinitroanilino)hexansäureChEBI
Registry NumbersSources
Reaxys:2821079Reaxys
CAS:10466-72-5ChemIDplus
Citations