EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:179176 - Heptan-2R-ol

Default Structure
ChEBI IDCHEBI:179176
ChEBI NameHeptan-2R-ol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC7H16O
Net Charge0
Average Mass116.204
Monoisotopic Mass116.12012
SMILESCCCCC[C@@H](C)O
InChIInChI=1S/C7H16O/c1-3-4-5-6-7(2)8/h7-8H,3-6H2,1-2H3/t7-/m1/s1
InChIKeyCETWDUZRCINIHU-SSDOTTSWSA-N
ChEBI Ontology
Outgoing Relation(s)
Heptan-2R-ol (CHEBI:179176) is a aliphatic alcohol (CHEBI:2571)
IUPAC Name 
(2R)-heptan-2-ol
Manual XrefsDatabases
5360736ChemSpider
LMFA05000477LIPID MAPS
Registry NumbersSources
CAS:6033-24-5ChemIDplus