EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:8474 - propane-2-thiol

ChEBI IDCHEBI:8474
ChEBI Namepropane-2-thiol
Stars
DefinitionAn alkanethiol that is propane substituted by a sulfanyl group at position 2.
Last Modified13 April 2015
DownloadsMolfile
FormulaC3H8S
Net Charge0
Average Mass76.164
Monoisotopic Mass76.03467
SMILESCC(C)S
InChIInChI=1S/C3H8S/c1-3(2)4/h3-4H,1-2H3
InChIKeyKJRCEJOSASVSRA-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
propane-2-thiol (CHEBI:8474) is a alkanethiol (CHEBI:47908)
IUPAC Name 
propane-2-thiol
Synonyms  Source
Propane-2-thiolKEGG COMPOUND
Isopropyl mercaptanKEGG COMPOUND
2-PropanethiolKEGG COMPOUND
1-MethylethanethiolChemIDplus
2-MercaptopropaneChemIDplus
2-PropanethiolChemIDplus
Manual XrefsDatabases
C08391KEGG COMPOUND
C00001268KNApSAcK
Registry NumbersSources
Reaxys:605260Reaxys
CAS:75-33-2KEGG COMPOUND
CAS:75-33-2ChemIDplus
Citations