CHEBI:49477 - arsanilic acid

ChEBI IDCHEBI:49477
ChEBI Namearsanilic acid
Stars
Secondary ChEBI IDsCHEBI:29859, CHEBI:49476
Last Modified22 February 2017
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC6H8AsNO3
Net Charge0
Average Mass217.056
Monoisotopic Mass216.97201
SMILESNc1ccc([As](=O)(O)O)cc1
InChIInChI=1S/C6H8AsNO3/c8-6-3-1-5(2-4-6)7(9,10)11/h1-4H,8H2,(H2,9,10,11)
InChIKeyXKNKHVGWJDPIRJ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
arsanilic acid (CHEBI:49477) is a organoarsonic acid (CHEBI:22638)
arsanilic acid (CHEBI:49477) is conjugate acid of arsanilate(1−) (CHEBI:36048)
Incoming Relation(s)
N-acetyltyrosine-4-azobenzenearsonic acid (CHEBI:53741) has functional parent arsanilic acid (CHEBI:49477)
4-arsonophenyldiazenyl group (CHEBI:53699) has functional parent arsanilic acid (CHEBI:49477)
4,4'-azodibenzenearsonic acid (CHEBI:53554) has functional parent arsanilic acid (CHEBI:49477)
tyrosine-4-azobenzenearsonate (CHEBI:53697) has functional parent arsanilic acid (CHEBI:49477)
arsanilate(1−) (CHEBI:36048) is conjugate base of arsanilic acid (CHEBI:49477)
IUPAC Name 
(4-aminophenyl)arsonic acid
Synonyms  Source
4-AMINOPHENYLARSONIC ACIDPDBeChem
arsanilic acidNIST Chemistry WebBook
4-arsanilic acidNIST Chemistry WebBook
p-arsanilic acidNIST Chemistry WebBook
4-aminobenzenearsonic acidChemIDplus
ArsanilsäureChEBI
Manual XrefsDatabases
ASRPDBeChem
DB03006DrugBank
3549DrugCentral
1919VSDB
Registry NumbersSources
Beilstein:1102334Beilstein
Gmelin:406354Gmelin
CAS:98-50-0ChemIDplus
CAS:98-50-0NIST Chemistry WebBook