Ethyl octanoate

Basic Information

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CAS Number

106-32-1

Molecular Formula

C10H20O2

Molecular Weight

172.27 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Physical Properties

Melting Point

−48-−47 °C

Boiling Point

206-208 °C

Solubility

ethanol: soluble1ml/4ml, clear, colorless (70% ethanol)

Refractive Index

n20/D 1.417(lit.)

Vapor Pressure

0.02 mmHg ( 25 °C)

SMILES

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CCCCCCCC(=O)OCC

InChI

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

InChIKey

YYZUSRORWSJGET-UHFFFAOYSA-N

LogP

2.910000000000001

Topological Polar Surface Area

26.3 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

110

Safety Information

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GHS Hazard Pictograms

H315

Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

Explosive Limit

0.7%(V)

Toxicity

LD50 orally in rats: 25,960 mg/kg, P. M. Jenner et al., Food Cosmet. Toxicol. 2, 327 (1964)

Synonyms & References

English

Ethyl caprylate
CAPRYLIC ACID-ETHYL
CAPRYLIC ACID ETHYL ESTER
ETHYL N-CAPRYLATE
ETHYL N-OCTANOATE
ETHYL OCTANOATE
ETHYL OCTYLATE
FEMA 2449
N-CAPRYLIC ACID ETHYL ESTER
N-OCTANOIC ACID ETHYL ESTER
OCTANOIC ACID ETHYL ESTER
RARECHEM AL BI 0166
Ethyl octoate
Ethyl Octlate
ethyloctanoate,ethylcaprylate
CAPRYLIC ACID ETHYLESTER(SG)
Ethyloctanoat
CAPRYLIC ACID ETHYLESTER(AS)
ETHYL CAPRYLATE, SYNTHESIS GRADE
Ethyl Esters in Palm Kernel Oil
Ethyl carprylate
Ethyl octanoate1000µg
Ethyl octylate
2a,7,10,12a,13,15a,16,18a,21a,23,26,28a,29,31a,32,34a,37a,42,45,48,51,58,61,64,67,77,80,83,86,93,96,
n-Octanoic Acid Ethyl Ester
Ethyl octanoate
ETHYL CAPRYLATE
Ethyl n-Caprylate

MDL Number

MFCD00009552

Customs Code

29159080

FAQ

What is Ethyl octanoate (CAS: 106-32-1)?

Ethyl octanoate is a chemical compound with the formula C10H20O2. It is a colorless liquid with a fruity, ester-like odor commonly associated with apple and peach notes. Ethyl octanoate is soluble in alcohol and ether but has limited solubility in water. It is widely used in flavor and fragrance industries due to its pleasant aroma and chemical stability.

What are the main uses of Ethyl octanoate (CAS: 106-32-1)?

Ethyl octanoate is primarily used in the food industry as a flavoring agent, particularly in confectionery and beverages, to impart a sweet, fruity aroma. It also finds applications in the pharmaceutical industry as a solvent and in research for its use in organic synthesis. Additionally, it is used in the production of perfumes and cosmetics for its aromatic properties.

Is Ethyl octanoate (CAS: 106-32-1) safe?

Ethyl octanoate is generally considered safe when used in accordance with recommended exposure levels. It has low toxicity and is not classified as a hazardous substance under standard safety regulations. However, proper handling and protective measures, such as using gloves and ensuring good ventilation, are recommended to avoid skin contact and inhalation risks.

How should Ethyl octanoate (CAS: 106-32-1) be stored?

Ethyl octanoate should be stored in a cool, dry, and well-ventilated place, away from direct sunlight. It is best kept in tightly sealed, airtight containers made of glass or stainless steel to prevent evaporation and contamination. The storage temperature should be maintained between 0°C to 25°C to ensure stability and prolong shelf life.