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CHEBI:16555 - ethanethioic S-acid

ChEBI IDCHEBI:16555
ChEBI Nameethanethioic S-acid
Stars
ASCII Nameethanethioic S-acid
DefinitionA thioacetic acid that is acetic acid in which the oxygen atom of the hydroxy group has been replaced by a sulfur atom.
Secondary ChEBI IDCHEBI:9547
Last Modified7 July 2022
DownloadsMolfile
FormulaC2H4OS
Net Charge0
Average Mass76.120
Monoisotopic Mass75.99829
SMILESCC(=O)S
InChIInChI=1S/C2H4OS/c1-2(3)4/h1H3,(H,3,4)
InChIKeyDUYAAUVXQSMXQP-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
ethanethioic S-acid (CHEBI:16555) is a thioacetic acid (CHEBI:26952)
ethanethioic S-acid (CHEBI:16555) is tautomer of ethanethioic O-acid (CHEBI:46800)
Incoming Relation(s)
S-methyl thioacetate (CHEBI:51280) has functional parent ethanethioic S-acid (CHEBI:16555)
S-(3-hydroxypropyl)-thioacetate (CHEBI:192554) has functional parent ethanethioic S-acid (CHEBI:16555)
thioglycine (CHEBI:46799) has functional parent ethanethioic S-acid (CHEBI:16555)
ethanethioic O-acid (CHEBI:46800) is tautomer of ethanethioic S-acid (CHEBI:16555)
IUPAC Name 
ethanethioic S-acid
Synonyms  Source
Thioacetic acidKEGG COMPOUND
acetyl mercaptanNIST Chemistry WebBook
thioacetic S-acidNIST Chemistry WebBook
CH3COSHNIST Chemistry WebBook
Manual XrefsDatabases
C01857KEGG COMPOUND
Registry NumbersSources
Gmelin:49262Gmelin
Reaxys:773684Reaxys
CAS:507-09-5KEGG COMPOUND
CAS:507-09-5NIST Chemistry WebBook
CAS:507-09-5ChemIDplus
Citations