Heptyl hexanoate
CAS Registry Number®
6976-72-3
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CAS Name
Heptyl hexanoateMolecular Formula
C13H26O2Molecular Mass
214.34Cite this Page
Heptyl hexanoate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=6976-72-3 (retrieved ) (CAS RN: 6976-72-3). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
261 °CMelting Point (1)
-34.4 °CDensity (2)
0.8616 g/cm³ @ Temp: 20 °C
Source(s)
- (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)
- (2) Kore, S. A.; Trudy Vsesoyuznogo Nauchno-Issledovatel'skogo Instituta Sinteticheskikh i Natural'nykh Dushistykh Veshchestv, (1968), No. 8, 320-4, CAplus
Other Names and Identifiers
InChI
InChI=1S/C13H26O2/c1-3-5-7-8-10-12-15-13(14)11-9-6-4-2/h3-12H2,1-2H3
InChIKey
InChIKey=QEKCBKVWQYEUGY-UHFFFAOYSA-N
SMILES
C(OCCCCCCC)(CCCCC)=O
Canonical SMILES
O=C(OCCCCCCC)CCCCC
Other Names for this Substance
- Hexanoic acid, heptyl ester
- Heptyl hexanoate
- 1-Heptyl hexanoate
- Heptyl caproate
- NSC 24779
