Heptyl butyrate
CAS Registry Number®
5870-93-9
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CAS Name
Heptyl butyrateMolecular Formula
C11H22O2Molecular Mass
186.29Cite this Page
Heptyl butyrate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=5870-93-9 (retrieved ) (CAS RN: 5870-93-9). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
225.8 °CMelting Point (1)
-57.5 °CDensity (2)
0.8827 g/cm³
Source(s)
- (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)
- (2) Hoffmann, W. L.; Riechstoffe und Aromen, (1959), 9, 273-6, CAplus
Other Names and Identifiers
InChI
InChI=1S/C11H22O2/c1-3-5-6-7-8-10-13-11(12)9-4-2/h3-10H2,1-2H3
InChIKey
InChIKey=JPQHLIYIQARLQM-UHFFFAOYSA-N
SMILES
C(OCCCCCCC)(CCC)=O
Canonical SMILES
O=C(OCCCCCCC)CCC
Other Names for this Substance
- Butanoic acid, heptyl ester
- Butyric acid, heptyl ester
- Heptyl butyrate
- Heptyl butanoate
