CHEBI:194702 - 2-[(4-Chlorophenyl)thio]acetic acid

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 2-[(4-Chlorophenyl)thio]acetic acid
ChEBI ID CHEBI:194702
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C8H7ClO2S
Net Charge 0
Average Mass 202.650
Monoisotopic Mass 201.98553
InChI InChI=1S/C8H7ClO2S/c9-6-1-3-7(4-2-6)12-5-8(10)11/h1-4H,5H2,(H,10,11)
InChIKey YPKLXLYGMAWXDO-UHFFFAOYSA-N
SMILES ClC1=CC=C(SCC(O)=O)C=C1
ChEBI Ontology
Outgoing 2-[(4-Chlorophenyl)thio]acetic acid (CHEBI:194702) is a aryl sulfide (CHEBI:35683)
IUPAC Name
2-(4-chlorophenyl)sulanylacetic acid
Manual Xref Database
50091 ChemSpider
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