2-Methoxy-5-(2-methyl-2-propanyl)aniline

Basic Information

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CAS Number

3535-88-4

Molecular Formula

C11H17NO

Molecular Weight

179.26 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Physical Properties

Melting Point

29-30 °C

Boiling Point

204-208 °C

Refractive Index

1.5320 (estimate)

SMILES

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CC(C)(C)C1=CC(=C(C=C1)OC)N

InChI

InChI=1S/C11H17NO/c1-11(2,3)8-5-6-10(13-4)9(12)7-8/h5-7H,12H2,1-4H3

InChIKey

DLTLFDQLMFMTRQ-UHFFFAOYSA-N

LogP

2.5749000000000004

Topological Polar Surface Area

35.25 Å²

Hydrogen Bond Donor/Acceptor

2 / 2

Complexity

162

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H312 Harmful in contact with skin
Acute toxicity, dermal

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H332 Harmful if inhaled
Acute toxicity, inhalation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

AS-60550
5-tert-butyl-2-methoxy-phenylamine
A822754
5-tert-Butyl-o-anisidine, 97%
5-(tert-butyl)-2-methoxyaniline
SCHEMBL330163
2-Amine-4-Tert-Butyl Anisole
DLTLFDQLMFMTRQ-UHFFFAOYSA-N
MFCD00026299
FT-0600547
D94724
5-tert-Butyl-2-methoxyaniline
Benzenamine, 5-(1,1-dimethylethyl)-2-methoxy-
AKOS000120108
2-Amino-4-tert-butylanisole
5-tert-Butyl-o-anisidine
SY274621
4-tert-Butyl-o-anisidine
3535-88-4
2-Amine-4-tert-butylanisole
CS-0154915
AMY28515
5-tert-butyl-O-anisidine
5-Tert-Butyl-2-Methoxyaniline
2-AMINE-4-TERT-BUTYL-ARISOLE
4-tert-butyl-2-methoxyaniline
5-tert-butyl-2-methoxybenzenamine
2-amino-4-tert-butylanisole
4-tert-butyl-2-methoxy-aniline
5-[(1,1-dimethyl)ethyl]-2-methoxyaniline
5-tert-Butyl-2-methoxy-anilin

MDL Number

MFCD00026299

Customs Code

2922299090

FAQ

What are the physical and chemical properties of 2-Methoxy-5-(2-methyl-2-propanyl)aniline (CAS: 3535-88-4)?

2-Methoxy-5-(2-methyl-2-propanyl)aniline is a white crystalline solid with a molecular weight of approximately 228.34 g/mol. It is slightly soluble in water but soluble in organic solvents like ethanol and acetone. Chemically, it is moderately reactive, particularly in its substitution reactions. It has a melting point of 52-54°C and a boiling point of 250-252°C. It is slightly basic and can undergo typical aromatic reactions such as electrophilic substitution and nucleophilic aromatic substitution.

How is 2-Methoxy-5-(2-methyl-2-propanyl)aniline (CAS: 3535-88-4) typically synthesized?

2-Methoxy-5-(2-methyl-2-propanyl)aniline is typically synthesized via a Friedel-Crafts alkylation of 2-methoxyaniline with 2-methyl-2-propanol in the presence of aluminum chloride as a catalyst. The yield is usually around 80%, and the product is purified by recrystallization. This method ensures good selectivity and efficiency, making it a common route for its industrial production.

What industries use 2-Methoxy-5-(2-methyl-2-propanyl)aniline (CAS: 3535-88-4)?

2-Methoxy-5-(2-methyl-2-propanyl)aniline finds application in various industries. It is used in the pharmaceutical sector for the synthesis of certain drugs, in the polymer industry as an additive, in the sensor technology for detecting specific chemicals, and in the semiconductor industry for its use in photoresists and other materials. Its unique chemical properties make it valuable in these diverse fields.

What precautions should be taken when handling 2-Methoxy-5-(2-methyl-2-propanyl)aniline (CAS: 3535-88-4)?

When handling 2-Methoxy-5-(2-methyl-2-propanyl)aniline, it is crucial to use appropriate personal protective equipment (PPE), including gloves, goggles, and a lab coat. It should be stored in a cool, dry place away from direct sunlight and heat sources. Work should always be conducted in a fume hood to minimize inhalation risks. In case of a spill, it should be carefully cleaned up using appropriate absorbent materials, and the area should be well-ventilated. Always refer to the Safety Data Sheet (SDS) for detailed handling and disposal instructions.