(2-Methyl-2-propanyl)benzene

Basic Information

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CAS Number

98-06-6

Molecular Formula

C10H14

Molecular Weight

134.22 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Hydrocarbons

Basic Physical Properties

Melting Point

−58 °C

Boiling Point

168°C

Density

0.867 g/mL at 25 °C

Water Solubility

0.03 g/L (20 ºC)

Solubility

29.5mg/l

Refractive Index

n20/D 1.492(lit.)

Vapor Pressure

4.79 mmHg ( 37.7 °C)

SMILES

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CC(C)(C)c1ccccc1

InChI

InChI=1S/C10H14/c1-10(2,3)9-7-5-4-6-8-9/h4-8H,1-3H3

InChIKey

YTZKOQUCBOVLHL-UHFFFAOYSA-N

LogP

2.9841000000000015

Topological Polar Surface Area

0.0 Å²

Hydrogen Bond Donor/Acceptor

0 / 0

Complexity

91.1

Safety Information

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GHS Hazard Pictograms

H226

H319

Hazard Statement

H226 Flammable liquid and vapor
Flammable liquids

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Hazard Class

Class 3 Class 3

Stability

Stable. Flammable. Incompatible with oxidizing agents, combustible material.

Explosive Limit

0.8-5.6%(V)

Synonyms & References

English

tert-Butylbenzene
(1,1-Dimethylethyl)benzene
2-Methyl-2-phenylpropane
Butylbenzene
Benzene,tert-butyl
Dimethylethylbenzene
Phenyltrimethylmethane
Pseudobutylbenzene
T-BUTYLBENZENE
Trimethylphenylmethane
Benzene, tert-butyl- (8CI)
NSC 6557
t-Butylbenzene

MDL Number

MFCD00008816

Customs Code

2902909090

FAQ

What is (2-Methyl-2-propanyl)benzene (CAS: 98-06-6)?

(2-Methyl-2-propanyl)benzene, also known as isopropylbenzene, is an aromatic hydrocarbon with the chemical formula C9H12. It is a colorless liquid with a mild, characteristic odor. This compound is used in various applications due to its chemical stability and reactivity.

What are the main uses of (2-Methyl-2-propanyl)benzene (CAS: 98-06-6)?

(2-Methyl-2-propanyl)benzene is widely used in the pharmaceutical industry as a precursor for the synthesis of various drugs. It is also utilized in the production of detergents, solvents, and adhesives. Additionally, it serves as a component in some chemical reactions and as a model compound in research settings.

Is (2-Methyl-2-proanyl)benzene (CAS: 98-06-6) safe?

(2-Methyl-2-proanyl)benzene is generally considered safe under normal use conditions. However, it is important to handle this compound with care, as it may cause skin and eye irritation. Protective measures include wearing appropriate personal protective equipment such as gloves and safety goggles. It is also advisable to avoid inhalation of vapors and to ensure proper ventilation in the workplace.

How should (2-Methyl-2-proanyl)benzene (CAS: 98-06-6) be stored?

(2-Methyl-2-proanyl)benzene should be stored in a cool, dry place away from direct sunlight and sources of ignition. It is recommended to store it in closed, tightly sealed containers made of appropriate materials to prevent leakage. The temperature should be maintained below 30°C, and the container should be checked regularly for any signs of deterioration or damage. Adequate ventilation is necessary during storage to prevent the accumulation of flammable vapors.