EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:179536 - Propyl heptanoate
| Formula | C10H20O2 |
| Net Charge | 0 |
| Average Mass | 172.268 |
| Monoisotopic Mass | 172.14633 |
| SMILES | CCCCCCC(=O)OCCC |
| InChI | InChI=1S/C10H20O2/c1-3-5-6-7-8-10(11)12-9-4-2/h3-9H2,1-2H3 |
| InChIKey | UWZVPQKWYFZLLW-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Propyl heptanoate (CHEBI:179536) is a fatty acid ester (CHEBI:35748) |
| IUPAC Name |
|---|
| propyl heptanoate |
| Manual Xrefs | Databases |
|---|---|
| 199694 | ChemSpider |
| HMDB0034457 | HMDB |
| LMFA07011004 | LIPID MAPS |
| Registry Numbers | Sources |
|---|---|
| CAS:7778-87-2 | ChemIDplus |