4-Isopropenyl-1-methylcyclohexene

Basic Information

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CAS Number

8008-57-9

Molecular Formula

C10H16

Molecular Weight

136.24 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Hydrocarbons

Basic Physical Properties

Melting Point

-95.5 deg C

Boiling Point

175 °C

Density

0.843 g/mL at 25 °C

Refractive Index

n20/D 1.473

SMILES

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CC1=CCC(CC1)C(=C)C

InChI

InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3

InChIKey

XMGQYMWWDOXHJM-UHFFFAOYSA-N

LogP

3.308900000000002

Topological Polar Surface Area

0.0 Å²

Hydrogen Bond Donor/Acceptor

0 / 0

Complexity

163

Safety Information

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GHS Hazard Pictograms

H226

Hazard Statement

H226 Flammable liquid and vapor
Flammable liquids

Hazard Class

Class 3.2 Class 3.2

Synonyms & References

English

Oil of Orange
Citrus sinensis Oil
Citrus sinensis peel extract
Neroli Oil
Neroli oil, pommade
Oil ofOrange Flowers
Oil, origanum
Oils, orange, sweet
Oil sweet orange
Orange flower oil
Orange leaf oil
Orange Oil
Orange oil expressed
Orange oil sweet
Orange oil, sweet, expressed
Orange peel oil terpeneless
Orange peel sweet extract
Orange sweet oil, expressed
Sweet orange oil
Orange Sweet Oil
OIL, ORANGE(RG)
Citrus aurantium
Citrus sinensis

MDL Number

MFCD00147798

FAQ

What is 4-Isopropenyl-1-methylcyclohexene (CAS: 8008-57-9)?

4-Isopropenyl-1-methylcyclohexene is a cyclic hydrocarbon with the CAS number 8008-57-9. It has the chemical formula C11H20. This compound exhibits a unique molecular structure with a double bond and a methyl group attached to a cyclohexene ring.

What are the main uses of 4-Isopropenyl-1-methylcyclohexene (CAS: 8008-57-9)?

4-Isopropenyl-1-methylcyclohexene is primarily used in the synthesis of various organic compounds, including pharmaceuticals and agrochemicals. It is also utilized as a fragrance ingredient and a precursor in the production of other chemicals.

Is 4-Isopropenyl-1-methylcyclohexene (CAS: 8008-57-9) safe?

4-Isopropenyl-1-methylcyclohexene is generally considered safe for industrial and laboratory use. However, it is toxic if ingested or inhaled. Proper handling and ventilation are essential. Users should wear appropriate personal protective equipment and follow safety guidelines as per the Material Safety Data Sheet (MSDS).

How should 4-Isopropenyl-1-methylcyclohexene (CAS: 8008-57-9) be stored?

4-Isopropenyl-1-methylcyclohexene should be stored in a cool, dry, and well-ventilated area away from direct sunlight and heat sources. It should be kept in a tightly sealed container to prevent contamination and degradation. Avoid storing in high humidity environments as this can affect its stability.