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Key Documents

112321

Sigma-Aldrich

Ethyl octanoate

ReagentPlus®, ≥99%

Synonym(s):

Ethyl caprylate

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About This Item

Linear Formula:
CH3(CH2)6COOC2H5
CAS Number:
Molecular Weight:
172.26
Beilstein:
1754470
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

vapor pressure

0.02 mmHg ( 25 °C)

Quality Level

product line

ReagentPlus®
Selectophore

Assay

≥99%

refractive index

n20/D 1.417 (lit.)

bp

206-208 °C (lit.)

mp

−48-−47 °C (lit.)

density

0.867 g/mL at 20 °C (lit.)

functional group

ester

SMILES string

CCCCCCCC(=O)OCC

InChI

1S/C10H20O2/c1-3-5-6-7-8-9-10(11)12-4-2/h3-9H2,1-2H3

InChI key

YYZUSRORWSJGET-UHFFFAOYSA-N

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General description

Ethyl octanoate is a powerful odourant found in mead (a traditional drink that contains alcohol).

Application

Ethyl octanoate, found in Burgundy wine, was used to study its partition co-efficient in water in model wine using the headspace method.

Legal Information

ReagentPlus is a registered trademark of Merck KGaA, Darmstadt, Germany
Selectophore is a trademark of Merck KGaA, Darmstadt, Germany

Pictograms

Environment

Hazard Statements

Precautionary Statements

Hazard Classifications

Aquatic Chronic 2

Storage Class Code

10 - Combustible liquids

WGK

WGK 2

Flash Point(F)

167.0 °F - closed cup

Flash Point(C)

75 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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