4-Penten-1-yl acetate

Basic Information

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CAS Number

1576-85-8

Molecular Formula

C7H12O2

Molecular Weight

128.17 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

-62.68°C (estimate)

Boiling Point

151°C

Flash Point

114 °F

Refractive Index

n20/D 1.418(lit.)

SMILES

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CC(=O)OCCCC=C

InChI

InChI=1S/C7H12O2/c1-3-4-5-6-9-7(2)8/h3H,1,4-6H2,2H3

InChIKey

LVHDNIMNOMRZMF-UHFFFAOYSA-N

LogP

1.5157

Topological Polar Surface Area

26.3 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

97.1

Safety Information

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Hazard Statement

H226 Flammable liquid and vapor
Flammable liquids

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H400 Very toxic to aquatic life
Hazardous to the aquatic environment, acute hazard

Hazard Class

Class 3 Class 3

Synonyms & References

English

4-Penten-1-yl acetate
5-Acetoxy-1-pentene
pent-4-ene-1-yl acetate
Acetic Acid 4-Penten-1-yl Ester
4-Pentenyl Acetate
Acetic Acid 4-Pentenyl Ester
pent-4-enyl acetate
4-Penten-1-ol,acetate (6CI,7CI,8CI,9CI)
1-Acetoxy-4-pentene
NSC102504
4-Pentenyl acetate
Acetic acid 4-pentenyl ester

MDL Number

MFCD00008723

Customs Code

2915390090

FAQ

What is 4-Penten-1-yl acetate (CAS: 1576-85-8)?

4-Penten-1-yl acetate (CAS: 1576-85-8) is an ester compound with the chemical formula C10H18O2. It is a clear, colorless liquid with a characteristic fruity aroma commonly used in the fragrance and flavor industry.

What are the main uses of 4-Penten-1-yl acetate (CAS: 1576-85-8)?

4-Penten-1-yl acetate (CAS: 1576-85-8) is widely used as a flavor and fragrance ingredient in the food and perfume industries. It is also utilized in the pharmaceutical and research sectors for its sensory properties.

Is 4-Penten-1-yl acetate (CAS: 1576-85-8) safe?

4-Penten-1-yl acetate (CAS: 1576-85-8) is generally considered safe for its intended uses in the food, fragrance, and perfume industries. However, it should be handled with care, and appropriate personal protective equipment should be used to avoid skin and eye contact.

How should 4-Penten-1-yl acetate (CAS: 1576-85-8) be stored?

4-Penten-1-yl acetate (CAS: 1576-85-8) should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a sealed container to prevent evaporation and contamination. Storage temperatures should not exceed 25°C (77°F) to ensure product stability.