(Z)-hex-3-en-1-yl acetate

Basic Information

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CAS Number

3681-71-8

Molecular Formula

C8H14O2

Molecular Weight

142.2 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

Boiling Point

75-76 °C/23 mmHg

Solubility

1 ml in 1 ml 95% alcohol (in ethanol)

Refractive Index

n20/D 1.425-1.429<br />n20/D 1.427(lit.)

SMILES

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CC(OCC/C=C\CC)=O

InChI

InChI=1S/C8H14O2/c1-3-4-5-6-7-10-8(2)9/h4-5H,3,6-7H2,1-2H3/b5-4-

InChIKey

NPFVOOAXDOBMCE-PLNGDYQASA-N

LogP

1.9058

Topological Polar Surface Area

26.3 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

116

Safety Information

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GHS Hazard Pictograms

H226

Hazard Statement

H226 Flammable liquid and vapor
Flammable liquids

Hazard Class

Class 3 Class 3

Sensitiveness

对光敏感

Synonyms & References

English

ACETIC ACID CIS-3-HEXEN-1-YL ESTER
ACETIC ACID CIS-3-HEXENYL ESTER
C3 HEXENYL ACETATE
CIS-3-HEXEN-1-YL ACETATE
CIS-3-HEXENYL ACETATE
FEMA 3171
HEX-3(CIS)-ENYL ACETATE
LEAF ACETATE
VERDURAL
(Z)-3-HEXENYL ACETATE
(3Z)-3-Hexenyl acetate
(Z)-3-hexen-1-ol acetate
(Z)-3-Hexen-1-yl, acetate
(Z)-3-hexenol acetate
(Z)-hex-3-en-1-yl acetate
(Z)-Hex-3-enyl acetate
3(Z)-hexenyl acetate
3-Hexen-1-ol,acetate,(Z)-
3-Hexenol acetate, cis
3-hexenylacetate
(cis)-3-Hexenyl acetate
cis-3-Hexenyl acetate Odor Standard
(3Z)-3-Hexen-1-ol acetate,(3Z)-C-3-Hexenyl acetate,Leaf acetate
3-Hexen-1-yl salicylate
3-hexenylsalicylate
C3 HEXENYL SALICYLATE
cis-3-hexen-1-yl salicylate
cis-3-hexene-1-ol acetate
cis-3-hexenyl salkylate
Cis-Hexenyl Salicylate
HEX-3

MDL Number

MFCD00036563

Customs Code

2915390090

FAQ

What is (Z)-hex-3-en-1-yl acetate (CAS: 3681-71-8)?

(Z)-hex-3-en-1-yl acetate is a chemical compound with the formula C8H16O2. It belongs to the class of esters and is characterized by its cis-configuration (Z) in the hex-3-en-1-yl group. This compound is a colorless liquid with a mild, pleasant odor, commonly used in fragrance and flavor applications. Its molecular structure includes a six-carbon chain with a double bond and an acetyl group, contributing to its chemical reactivity and solubility properties.

What are the main uses of (Z)-hex-3-en-1-yl acetate (CAS: 3681-71-8)?

(Z)-hex-3-en-1-yl acetate finds applications in pharmaceuticals as a flavoring agent and in the fragrance industry for its aromatic properties. It is also used in research for organic synthesis and as a component in specialty chemicals. Additionally, it may serve as an intermediate in the production of various industrial products, including solvents and polymer additives. Its versatility makes it relevant in multiple sectors, including food and cosmetics.

Is (Z)-hex-3-en-1-yl acetate (CAS: 3681-71-8) safe?

(Z)-hex-3-en-1-yl acetate is generally considered safe when handled properly, but it should be treated with standard chemical safety precautions. It is not classified as highly toxic, though prolonged exposure may cause mild irritation. Safety data sheets (SDS) recommend using gloves, goggles, and ensuring adequate ventilation. Always follow regulatory guidelines and consult professional handling protocols for optimal safety.

How should (Z)-hex-3-en-1-yl acetate (CAS: 3681-71-8) be stored?

(Z)-hex-3-en-1-yl acetate should be stored in a sealed, airtight container in a cool, dry place away from light and heat. Maintain storage temperatures below 25°C to ensure stability. Avoid exposure to air to prevent oxidation, and keep it in a well-ventilated area. Use dark-colored containers to minimize photodegradation and ensure compliance with chemical storage standards.