CHEBI:16555 - ethanethioic S-acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name ethanethioic S-acid
ChEBI ID CHEBI:16555
ChEBI ASCII Name ethanethioic S-acid
Definition A thioacetic acid that is acetic acid in which the oxygen atom of the hydroxy group has been replaced by a sulfur atom.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:9547
Supplier Information
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Formula C2H4OS
Net Charge 0
Average Mass 76.11856
Monoisotopic Mass 75.998
InChI InChI=1S/C2H4OS/c1-2(3)4/h1H3,(H,3,4)
InChIKey DUYAAUVXQSMXQP-UHFFFAOYSA-N
SMILES CC(S)=O
ChEBI Ontology
Outgoing 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 S-methyl thioacetate (CHEBI:51280) 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 Sources
acetyl mercaptan NIST Chemistry WebBook
CH3COSH NIST Chemistry WebBook
Thioacetic acid KEGG COMPOUND
thioacetic S-acid NIST Chemistry WebBook
Manual Xref Database
C01857 KEGG COMPOUND
View more database links
Registry Numbers Types Sources
49262 Gmelin Registry Number Gmelin
507-09-5 CAS Registry Number KEGG COMPOUND
507-09-5 CAS Registry Number NIST Chemistry WebBook
507-09-5 CAS Registry Number ChemIDplus
773684 Beilstein Registry Number Beilstein
773684 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
23298036 PubMed citation Europe PMC
Last Modified
13 April 2015