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CHEBI:91019 - 2-aminothiophenol

ChEBI IDCHEBI:91019
ChEBI Name2-aminothiophenol
Stars
DefinitionAn aryl thiol that is thiophenol substituted at position 2 by an amino group.
Last Modified26 January 2016
SubmitterSteve
DownloadsMolfile
FormulaC6H7NS
Net Charge0
Average Mass125.196
Monoisotopic Mass125.02992
SMILESNc1ccccc1S
InChIInChI=1S/C6H7NS/c7-5-3-1-2-4-6(5)8/h1-4,8H,7H2
InChIKeyVRVRGVPWCUEOGV-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mimosa pudica (ncbitaxon:76306) root (BTO:0001188) PubMed (26661932)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
2-aminothiophenol (CHEBI:91019) has role plant metabolite (CHEBI:76924)
2-aminothiophenol (CHEBI:91019) is a aryl thiol (CHEBI:82711)
2-aminothiophenol (CHEBI:91019) is a substituted aniline (CHEBI:48975)
IUPAC Name 
2-aminobenzene-1-thiol
Synonyms  Source
o-AminobenzenethiolChemIDplus
o-MercaptoanilineChemIDplus
2-MercaptanilineChemIDplus
1-Amino-2-mercaptobenzeneChemIDplus
2-AminobenzenethiolChemIDplus
o-AminothiophenolChemIDplus
Registry NumbersSources
Reaxys:606076Reaxys
CAS:137-07-5ChemIDplus
CAS:40451-21-6ChemIDplus
CAS:137-07-5NIST Chemistry WebBook
Citations