Pentyl_hexanoate Knowpia

Pentyl hexanoate
Names
	Preferred IUPAC name Pentyl hexanoate
Identifiers
CAS Number	540-07-8 ;
3D model (JSmol)	Interactive image;
ChemSpider	10424;
ECHA InfoCard	100.007.940
PubChem CID	10886;
UNII	5M61M1AL1H ;
CompTox Dashboard (EPA)	DTXSID0047581 ;
	InChI InChI=1S/C11H22O2/c1-3-5-7-9-11(12)13-10-8-6-4-2/h3-10H2,1-2H3 Key: WRFZKAGPPQGDDQ-UHFFFAOYSA-N; InChI=1/C11H22O2/c1-3-5-7-9-11(12)13-10-8-6-4-2/h3-10H2,1-2H3 Key: WRFZKAGPPQGDDQ-UHFFFAOYAW;
	SMILES CCCCCC(=O)OCCCCC;
Properties
Chemical formula	C11H22O2
Molar mass	186.295 g·mol−1
Density	0.858 g/mL
Boiling point	226 °C (439 °F; 499 K)
	Except where otherwise noted, data are given for materials in their standard state (at 25 °C [77 °F], 100 kPa). Infobox references

Pentyl hexanoate (C₅H₁₁COOC₅H₁₁) is an ester found in apple^[1] and pineapple fruits. It is closely related to pentyl butyrate and pentyl pentanoate, both of which are also present in fruits.

References edit

^ "Volatiles in Gravenstein Apple Essence Identified by GC-Mass Spectrometry". Chromsci.oxfordjournals.org. 1968-10-28. Archived from the original on 2013-04-15. Retrieved 2013-04-09.