1-(3-Bromo-5-methylphenyl)methanamine

Basic Information

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CAS Number

1177558-42-7

Molecular Formula

C8H10BrN

Molecular Weight

200.08 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Amines

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

SMILES

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Cc1cc(Br)cc(CN)c1

InChI

InChI=1S/C8H10BrN/c1-6-2-7(5-10)4-8(9)3-6/h2-4H,5,10H2,1H3

InChIKey

HFQTVASWWMLTLZ-UHFFFAOYSA-N

LogP

2.21622

Topological Polar Surface Area

26.02 Å²

Hydrogen Bond Donor/Acceptor

2 / 1

Synonyms & References

English

2-(Boc-amino)-2-phenylethylamine Hydrochloride
3-Bromo-5-methylbenzylamine
(3-bromo-5-methylphenyl)methanamine
3-bromo-5-methylBenzenemethanamine
3-bromo-a-methylbenzylamine

MDL Number

MFCD18392012

FAQ

What regulatory guidelines apply to 1-(3-Bromo-5-methylphenyl)methanamine (CAS: 1177558-42-7)?

1-(3-Bromo-5-methylphenyl)methanamine (CAS: 1177558-42-7) falls under the GHS classification for chemicals that may cause long-term or chronic harm. It is regulated under the REACH regulations in the EU, requiring manufacturers and importers to register the substance if the quantity exceeds 1 ton per year. Additionally, the FDA and EPA have specific requirements for the safe handling and disposal of this compound, especially in medical and industrial applications.

Are there alternatives to 1-(3-Bromo-5-methylphenyl)methanamine (CAS: 1177558-42-7) in synthesis?

Several alternatives can be used in the synthesis of 1-(3-Bromo-5-methylphenyl)methanamine (CAS: 1177558-42-7). Commonly, bromo substituents can be replaced with other halogen atoms like chlorine or iodine. Alternatively, the benzene ring can be modified with different substituents, such as trifluoromethyl or methoxy groups, providing a broader range of functional compounds for various applications.

What is the market or research trend for 1-(3-Bromo-5-methylphenyl)methanamine (CAS: 1177558-42-7)?

The market for 1-(3-Bromo-5-methylphenyl)methanamine (CAS: 1177558-42-7) is primarily driven by its applications in pharmaceuticals and research where it serves as a key intermediate. Recent trends show an increasing demand in the development of new anti-inflammatory drugs and research into its potential as a selective serotonin reuptake inhibitor (SSRI). The research focus is shifting towards understanding its biological interactions and exploring new synthesis methods for improved efficiency.

How should waste containing 1-(3-Bromo-5-methylphenyl)methanamine (CAS: 1177558-42-7) be handled?

Waste containing 1-(3-Bromo-5-methylphenyl)methanamine (CAS: 1177558-42-7) should be collected in appropriate, leak-proof containers and stored in a well-ventilated area. For disposal, it is recommended to consult with a hazardous waste management company that specializes in chemical waste. Proper incineration or professional waste disposal methods should be employed, and all necessary safety precautions, including personal protective equipment and environmental protection measures, must be followed to prevent environmental contamination.