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InChI=1S/CH4O/c1-2/h2H,1H3
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> Main
CHEBI:16555 - ethanethioic
S
-acid
Main
ChEBI Ontology
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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A thioacetic acid that is acetic acid in which the oxygen atom of the hydroxy group has been replaced by a sulfur atom.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
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Formula
C2H4OS
Net Charge
0
Average Mass
76.11856
Monoisotopic Mass
75.99829
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
)
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
Sources
acetyl mercaptan
NIST Chemistry WebBook
CH
3
COSH
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
Type
Source
23298036
PubMed citation
Europe PMC
Last Modified
07 July 2022