1-Isopropyl-4-methyl-1,4-cyclohexadiene

Basic Information

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CAS Number

99-85-4

Molecular Formula

C10H16

Molecular Weight

136.24 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Hydrocarbons

Basic Physical Properties

Melting Point

-59.03°C (estimate)

Boiling Point

182 °C

Density

0.85 g/mL at 25 °C

Solubility

water: soluble5%, clear, colorless to faintly yellow

Refractive Index

n20/D 1.474(lit.)

Vapor Pressure

~0.7 mmHg ( 20 °C)

SMILES

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CC(C)C1=CCC(=CC1)C

InChI

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

InChIKey

YKFLAYDHMOASIY-UHFFFAOYSA-N

LogP

3.308900000000002

Topological Polar Surface Area

0.0 Å²

Hydrogen Bond Donor/Acceptor

0 / 0

Complexity

171

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

Hazard Class

Class 3.2 Class 3.2

Synonyms & References

English

4-Isopropyl-1-methyl-1,4-cyclohexadiene
gamma-Terpinene
p-Mentha-1,4-diene
γ-Terpinene
1-methyl-4-propan-2-ylcyclohexa-1,4-diene
TERPINENE, gamma-(P)
&gamma
Gamma Terpinene

MDL Number

MFCD00001537

Customs Code

2902199090

FAQ

What is 1-Isopropyl-4-methyl-1,4-cyclohexadiene (CAS: 99-85-4)?

1-Isopropyl-4-methyl-1,4-cyclohexadiene (CAS: 99-85-4) is a cyclic diene compound with the molecular formula C9H16O. It features a six-membered ring with two double bonds, an isopropyl group at the 1-position, and a methyl group at the 4-position. This compound is commonly used in organic synthesis due to its reactivity and structural versatility.

What are the main uses of 1-Isopropyl-4-methyl-1,4-cyclohexadiene (CAS: 99-85-4)?

1-Isopropyl-4-methyl-1,4-cyclohexadiene (CAS: 99-85-4) is primarily used in pharmaceutical and chemical research for the synthesis of complex organic molecules. It serves as an intermediate in the production of various compounds, including polymers and fine chemicals. Its applications also extend to industrial processes and the development of new materials.

Is 1-Isopropyl-4-methyl-1,4-cyclohexadiene (CAS: 99-85-4) safe?

1-Isopropyl-4-methyl-1,4-cyclohexadiene (CAS: 99-85-4) is generally considered safe when handled properly. However, it should be treated with caution as it may have mild irritant properties. Safety standards recommend using appropriate personal protective equipment (PPE), such as gloves and goggles, and working in a well-ventilated area to minimize exposure risks.

How should 1-Isopropyl-4-methyl-1,4-cyclohexadiene (CAS: 99-85-4) be stored?

1-Isopropyl-4-methyl-1,4-cyclohexadiene (CAS: 99-85-4) should be stored in a cool, dry, and well-ventilated area away from light. It is best kept in a sealed, airtight container to prevent degradation. Storage conditions should maintain a temperature below 25°C and avoid high humidity to ensure stability and safety.