3-methylbutyl hexanoate
A fatty acid ester obtained by the formal condensation of the carboxy group of hexanoic acid (caproic acid) with the alcoholic hydroxy group of 3-methylbutan-1-ol (isoamylol).
Also appears inslm
Exact Synonyms
3-methylbutyl hexanoate
Related Synonyms
3-methylbutyl caproate
isoamyl caproate
isoamyl hexanoate
isopentyl caproate
isopentyl hexanoate
class Information
charge
0
formula
C11H22O2
has_dbxref
- CAS:2198-61-0
- HMDB:HMDB0033618
- Patent:CN101513250
- PMID:24333641
- Reaxys:1760611
has_obo_namespace
chebi_ontology
inchi
InChI=1S/C11H22O2/c1-4-5-6-7-11(12)13-9-8-10(2)3/h10H,4-9H2,1-3H3
inchikey
XVSZRAWFCDHCBP-UHFFFAOYSA-N
in_subset
mass
186.29120
monoisotopicmass
186.16198
smiles
CCCCCC(=O)OCCC(C)C
class Relations
Subclass of