3,7-Dimethyl-1,6-octadien-3-yl acetate

Basic Information

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CAS Number

115-95-7

Molecular Formula

C12H20O2

Molecular Weight

196.29 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

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Melting Point

85°C

Boiling Point

220 °C

Solubility

,Ethyl Acetate

Refractive Index

n20/D 1.453(lit.)

Vapor Pressure

0.1 mmHg ( 20 °C)

SMILES

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CC(=CCCC(C)(OC(=O)C)C=C)C

InChI

InChI=1S/C12H20O2/c1-6-12(5,14-11(4)13)9-7-8-10(2)3/h6,8H,1,7,9H2,2-5H3

InChIKey

UWKAYLJWKGQEPM-UHFFFAOYSA-N

LogP

3.2406000000000024

Topological Polar Surface Area

26.3 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

237

Safety Information

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GHS Hazard Pictograms

H315

H319

H335

Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Storage Conditions

2-8℃

Synonyms & References

English

3,7-Dimethylocta-1,6-dien-3-yl acetate
Linalyl Acetate
LINALYL ACETATE(AS)
3,7-Dimethyl-1,6-octadien-3-yl acetate
Linalyl acetate,synthetic
Bergamol
linalyl
FEMA 2636
Bergamiol
Phanteine
LAVANDEX(R)
Linalylacetat
linalolacetate
Acetic acid-li
LINALYL ACETATE
Linalyl acetate
1,5-Dimethyl-1-vinyl-4-hexenyl acetate,3,7-Dimethyl-1,6-octadien-3-yl acetate,3-Acetoxy-3,7-dimethyl...

MDL Number

MFCD00008907

Customs Code

2915390090

FAQ

What is 3,7-Dimethyl-1,6-octadien-3-yl acetate (CAT: 115-95-7)?

3,7-Dimethyl-1,6-octadien-3-yl acetate (CAS: 115-95-7) is a synthetic organic compound with the chemical formula C12H22O2. It is a colorless liquid with a pleasant, fruity odor and is commonly used as a fragrance ingredient. The compound is known for its stability and compatibility with various solvents, making it suitable for use in multiple applications.

What are the main uses of 3,7-Dimethyl-1,6-octadien-3-yl acetate (CAT: 115-95-7)?

3,7-Dimethyl-1,6-octadien-3-yl acetate (CAS: 115-95-7) is primarily used in the fragrance and flavor industry due to its aromatic properties. It serves as a synthetic aroma compound in perfumes, cosmetics, and food products. Additionally, it is utilized in research for its chemical versatility and in pharmaceutical development as a component in certain drug formulations.

Is 3,7-Dimethyl-1,6-octadien-3-yl acetate (CAT: 115-95-7) safe?

3,7-Dimethyl-1,6-octadien-3-ylacetate (CAS: 115-95-7) is generally considered safe when used in accordance with recommended guidelines. However, it should be handled with care, as prolonged exposure may cause skin or respiratory irritation. Proper protective equipment, such as gloves and masks, is advised during handling. It is classified as a low-toxicity compound and meets safety standards for use in fragrance and cosmetic products.

How should 3,7-Dimethyl-1,6-octadien-3-yl acetate (CAT: 115-95-7) be stored?

3,7-Dimethyl-1,6-octadien-3-yl acetate (CAS: 115-95-7) should be stored in a cool, dry, and well-ventilated place, away from direct sunlight. It is best kept in a sealed, airtight container made of glass or polyethylene to prevent contamination and evaporation. Storage at temperatures below 25°C and maintaining low humidity levels are recommended to ensure stability and prolong shelf life.