(2E)-3,7-Dimethyl-2,6-octadiene-1-thiol

Basic Information

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CAS Number

39067-80-6

Molecular Formula

C10H18S

Molecular Weight

170.32 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Hydrocarbons

Basic Physical Properties

Boiling Point

244.5 ºC

Density

0.875

Flash Point

97.2 ºC

Refractive Index

n20/D 1.501-1.503

SMILES

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CC(=CCC/C(=C/CS)/C)C

InChI

InChI=1S/C10H18S/c1-9(2)5-4-6-10(3)7-8-11/h5,7,11H,4,6,8H2,1-3H3/b10-7+

InChIKey

FACAUSJJVBMWLV-JXMROGBWSA-N

LogP

3.608900000000002

Topological Polar Surface Area

0.0 Å²

Hydrogen Bond Donor/Acceptor

0 / 0

Complexity

150

Synonyms & References

English

(E)-3,7-dimethylocta-2,6-diene-1-thiol
3-7-DIMETHYL-2.6-OCTADIEN-1-THIOL
Thiogeraniol
3,7-Dimethyl-2,6-octadien-1-thiol
3,7-dimethylocta-2,6-dienylmercaptan
FEMA 3472
GERANYL MERCAPTAN
geranyl thiol
THIOGERANIOL,NATURAL
3,7-Dimethyl-2,6-octadiene-1-thiol
Geranyl mercaptan
(E)-3,7-Dimethylocta-2,6-diene-1-thiol

MDL Number

MFCD00209533

Customs Code

2930909090

FAQ

What is (2E)-3,7-Dimethyl-2,6-octadiene-1-thiol (CAS: 39067-80-6)?

(2E)-3,7-Dimethyl-2,6-octadiene-1-thiol (CAS: 39067-80-6) is a colorless or slightly yellow liquid with a distinctive odor. It is a sulfur-containing compound with the molecular formula C9H16S and is used in various applications due to its unique properties.

What are the main uses of (2E)-3,7-Dimethyl-2,6-octadiene-1-thiol (CAS: 39067-80-6)?

(2E)-3,7-Dimethyl-2,6-octadiene-1-thiol (CAS: 39067-80-6) is primarily used in the fragrance and flavor industry, as a synthetic intermediate, and in research for its specific chemical properties. It is also used in the production of certain pharmaceuticals and agrochemicals.

Is (2E)-3,7-Dimethyl-2,6-octadiene-1-thiol (CAS: 39067-80-6) safe?

(2E)-3,7-Dimethyl-2,6-octadiene-1-thiol (CAS: 39067-80-6) is generally safe when used in appropriate concentrations and under proper handling conditions. However, it is important to follow safety guidelines, wear appropriate personal protective equipment, and ensure proper ventilation in the work environment to minimize potential health risks.

How should (2E)-3,7-Dimethyl-2,6-octadiene-1-thiol (CAS: 39067-80-6) be stored?

(2E)-3,7-Dimethyl-2,6-octadiene-1-thiol (CAS: 39067-80-6) should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed container to prevent evaporation and contamination. Optimal storage temperature should not exceed 25°C to ensure stability and safety of the compound.