CHEBI:173553 - Ethyl 2-(methylthio)acetate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
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 Ethyl 2-(methylthio)acetate
ChEBI ID CHEBI:173553
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C5H10O2S
Net Charge 0
Average Mass 134.190
Monoisotopic Mass 134.04015
InChI InChI=1S/C5H10O2S/c1-3-7-5(6)4-8-2/h3-4H2,1-2H3
InChIKey MDIAKIHKBBNYHF-UHFFFAOYSA-N
SMILES S(CC(OCC)=O)C
ChEBI Ontology
Outgoing Ethyl 2-(methylthio)acetate (CHEBI:173553) is a carboxylic ester (CHEBI:33308)
IUPAC Name
ethyl 2-methylsulanylacetate
Manual Xrefs Databases
70575 ChemSpider
HMDB0040263 HMDB
View more database links
Registry Number Type Source
4455-13-4 CAS Registry Number ChemIDplus