4-(2-Methyl-2-propanyl)benzonitrile

Basic Information

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CAS Number

4210-32-6

Molecular Formula

C11H13N

Molecular Weight

159.23 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Nitriles

Basic Physical Properties

Boiling Point

112°C/9mmHg

Refractive Index

n20/D 1.518(lit.)

SMILES

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CC(C)(C)C1=CC=C(C=C1)C#N

InChI

InChI=1S/C11H13N/c1-11(2,3)10-6-4-9(8-12)5-7-10/h4-7H,1-3H3

InChIKey

IIZURLNRIMKEDL-UHFFFAOYSA-N

LogP

2.85578

Complexity

183

Safety Information

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Hazard Statement

H312 Harmful in contact with skin
Acute toxicity, dermal

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H332 Harmful if inhaled
Acute toxicity, inhalation

Hazard Class

Class 6.1 Class 6.1

Synonyms & References

English

UNII-Y968PR6AS9
4-tert-Butylcyanobenzene
Benzonitrile, 4-(1,1-dimethylethyl)-
4-(tert-Butyl)benzonitrile
DTXSID70194945
AKOS005198603
CS-W022031
4-tert-Butyl-benzonitrile
SCHEMBL69655
AB02903
AMY19313
AC-11643
EC 224-137-2
NS00002673
FT-0619498
MFCD00075840
SY032654
4210-32-6
4-tert-Butylbenzonitrile
p-tert.-Butylbenzonitril
4-(1,1-dimethylethyl)benzonitrile
J-516005
Y968PR6AS9
Benzonitrile, p-tert-butyl-
P-T-BUTYLBENZONITRILE
p-tert-Butylbenzonitrile
IIZURLNRIMKEDL-UHFFFAOYSA-
4-t-Butylbenzonitrile
InChI=1/C11H13N/c1-11(2,3)10-6-4-9(8-12)5-7-10/h4-7H,1-3H3
B1576
EINECS 224-137-2

MDL Number

MFCD00075840

Customs Code

2926909090

FAQ

What regulatory guidelines apply to 4-(2-Methyl-2-propanyl)benzonitrile (CAS: 4210-32-6)?

4-(2-Methyl-2-propanyl)benzonitrile (CAS: 4210-32-6) is subject to various regulatory guidelines including GHS classification, REACH regulations, and FDA/EPA requirements for chemical safety, environmental protection, and handling. Specific regulations may vary depending on the country or region, so it is important to consult local guidelines for compliance.

Are there alternatives to 4-(2-Methyl-2-propanyl)benzonitrile (CAS: 4210-32-6) in synthesis?

Alternatives to 4-(2-Methyl-2-propanyl)benzonitrile (CAS: 4210-32-6) in synthesis include other benzonitriles, such as benzyl cyanide, or using different functional groups like ketones or aldehydes. Isomers and analogs can also be considered based on the specific synthesis requirements.

What is the market or research trend for 4-(2-Methyl-2-propanyl)benzonitrile (CAS: 4210-32-6)?

Research and market trends for 4-(2-Methyl-2-propanyl)benzonitrile (CAS: 4210-32-6) indicate increasing interest in its use as a precursor in the synthesis of various organic compounds. The compound is also being explored in pharmaceutical and polymer industries. Market trends suggest growing demand driven by technological advancements and expanding applications.

How should waste containing 4-(2-Methyl-2-propanyl)benzonitrile (CAS: 4210-32-6) be handled?

Waste containing 4-(2-Methyl-2-propanyl)benzonitrile (CAS: 4210-32-6) should be collected in appropriate containers, labeled with the correct chemical name and CAS number. Proper waste disposal methods include incineration or professional waste disposal services. Environmental protection precautions should be taken to prevent contamination of soil and water.