3,7-Dimethyl-1,6-octadien-3-ol

Basic Information

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CAS Number

78-70-6

Molecular Formula

C10H18O

Molecular Weight

154.25 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Hydrocarbons

Basic Physical Properties

Melting Point

25°C

Boiling Point

194-197 °C/720 mmHg

Density

0.87 g/mL at 25 °C

Water Solubility

1.45 g/L (25 ºC)

Solubility

ethanol: soluble1ml/4ml, clear, colorless (60% ethanol)

Refractive Index

n20/D 1.462(lit.)

Vapor Pressure

0.17 mmHg ( 25 °C)

Odor

Odor similar to that of bergamot oil and French lavender

SMILES

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

InChI

InChI=1S/C10H18O/c1-5-10(4,11)8-6-7-9(2)3/h5,7,11H,1,6,8H2,2-4H3

InChIKey

CDOSHBSSFJOMGT-UHFFFAOYSA-N

LogP

2.6698000000000013

Topological Polar Surface Area

20.23 Å²

Hydrogen Bond Donor/Acceptor

1 / 1

Complexity

154

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℃

Stability

Stable. Incompatible with strong oxidizing agents. Combustible.

Explosive Limit

0.9-5.2%(V)

Synonyms & References

English

3,7-Dimethylocta-1,6-dien-3-ol
(±)-3,7-dimethyl-octa-1,6-dien-3-ol
(±)-3,7-Dimethylocta-1,6-dien-3-ol
1,6-Octadien-3-ol, 3,7-dimethyl-
2,6-dimethyl-2,7-octadien-6-ol (linalool)
2,6-Dimethyl-2,7-octadiene-6-ol
3,7-dimethyl-1,6-octadien-3-ol (linalool)
3,7-dimethyl-1,6-octandien-3-ol (linalool)
Linalool
LINALOOL, DL-(SG)
(±)-3,7-Dimethyl-1,6-octadien-3-ol
2,6-DiMethyl-2,7-octadien-6-ol
3,7-Dimethyl-1,6-octadien-3-ol
3,7-Dimethyl-1.6-octadien-3-ol
3,7-dimethyloct-1,6-dien-3-ol
LINALLOL
Linalol
Linanool
Linolool
Phantol
2,6-Dimethylocta-2,7-dien-6-ol
beta-Linalool
allo-Ocimenol
LINALYL ALCOHOL
p-Linalool
(+-)-Linalool
.beta.-Linalool
Linalool (natural)
Caswell No. 526A
FEMA Number 2635
FEMA No. 2635

MDL Number

MFCD00008906

Customs Code

2905223000

FAQ

What is 3,7-Dimethyl-1,6-octadien-3-ol (CAS: 78-70-6)?

3,7-Dimethyl-1,6-octadien-3-ol (CAS: 78-70-6) is an organic compound with the molecular formula C10H18O. It is a colorless liquid known for its pleasant, fruity aroma. This compound is commonly used in fragrance and flavor industries due to its volatile and aromatic properties.

What are the main uses of 3,7-Dimethyl-1,6-octadien-3-ol (CAS: 78-70-6)?

3,7-Dimethyl-1,6-octadien-3-ol (CAS: 78-70-6) is primarily used in the fragrance and flavor industry to impart a sweet, floral scent. It also finds applications in pharmaceuticals as a solvent or intermediate, and in research for studying organic reactions and molecular structures.

Is 3,7-Dimethyl-1,6-octadien-3-ol (CAS: 78-70-6) safe?

3,7-Dimethyl-1,6-octadien-3-ol (CAS: 78-70-6) is generally considered safe when handled properly. However, it should be used with caution as it may cause skin or eye irritation. Proper protective equipment, such as gloves and goggles, is recommended during handling, and it should be stored away from heat and incompatible substances.

How should 3,7-Dimethyl-1,6-octadien-3-ol (CAS: 78-70-6) be stored?

3,7-Dimethyl-1,6-octadien-3-ol (CAS: 78-70-6) should be stored in a cool, dry place, away from direct sunlight. It is best kept in a sealed, airtight container to prevent evaporation and contamination. Avoid exposure to high temperatures and humidity to maintain its stability and quality.