CHEBI:133186 - 2-aminophenyl hydrogen sulfate

ChEBI IDCHEBI:133186
ChEBI Name2-aminophenyl hydrogen sulfate
Stars
DefinitionAn aryl sulfate that is 2-aminophenol in which the phenolic hydrogen has been replaced by a sulfo group.
Last Modified9 September 2016
SubmitterSteve
DownloadsMolfile
FormulaC6H7NO4S
Net Charge0
Average Mass189.192
Monoisotopic Mass189.00958
SMILESNc1ccccc1OS(=O)(=O)O
InChIInChI=1S/C6H7NO4S/c7-5-3-1-2-4-6(5)11-12(8,9)10/h1-4H,7H2,(H,8,9,10)
InChIKeyVSTZVCJQGSLNLL-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
2-aminophenyl hydrogen sulfate (CHEBI:133186) has functional parent 2-aminophenol (CHEBI:18112)
2-aminophenyl hydrogen sulfate (CHEBI:133186) is a aryl sulfate (CHEBI:37919)
2-aminophenyl hydrogen sulfate (CHEBI:133186) is a substituted aniline (CHEBI:48975)
2-aminophenyl hydrogen sulfate (CHEBI:133186) is conjugate acid of 2-aminophenyl sulfate (CHEBI:133194)
Incoming Relation(s)
2-aminophenyl sulfate (CHEBI:133194) is conjugate base of 2-aminophenyl hydrogen sulfate (CHEBI:133186)
IUPAC Name 
2-aminophenyl hydrogen sulfate
Synonyms  Source
2-aminophenol hydrogen sulfateChEBI
2-aminophenol sulfateChEBI
2-Aminophenyl sulfateChemIDplus
sulfuric acid mono-(2-aminophenyl ester)ChEBI
(2-aminophenyl)oxidanesulfonic acidHMDB
o-aminophenyl hydrogen sulfateChEBI
Manual XrefsDatabases
HMDB0061116HMDB
Registry NumbersSources
Reaxys:3051690Reaxys
CAS:40712-56-9ChemIDplus