1-[1-(4-Chlorophenyl)cyclobutyl]-3-methyl-1-butanamine

Basic Information

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CAS Number

84467-54-9

Molecular Formula

C15H22ClN

Molecular Weight

251.8 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Amines

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

SMILES

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CC(C)CC(C1(C2=CC=C(Cl)C=C2)CCC1)N

InChI

InChI=1S/C15H22ClN/c1-11(2)10-14(17)15(8-3-9-15)12-4-6-13(16)7-5-12/h4-7,11,14H,3,8-10,17H2,1-2H3

InChIKey

WQSACWZKKZPCHN-UHFFFAOYSA-N

LogP

4.135100000000002

Topological Polar Surface Area

26.02 Å²

Hydrogen Bond Donor/Acceptor

2 / 1

Synonyms & References

English

1-(1-(4-Chlorophenyl)cyclobutyl)-3-methylbutan-1-amine
Didesmethyl Sibutramine
1-[1-(4-Chlorophenyl)]-Alpha-(2-Methylpropyl) Cyclobutane Methanamine
1-[1-(4-chlorophenyl)cyclobutyl]-3-methylbutan-1-amine
Cyclobutanemethanamine,1-(4-chlorophenyl)-a-(2-methylpropyl)-
Didemethylsibutramine
N-Didemethylsibutramine
N-Didesmethylsibutramine

MDL Number

MFCD06658940

FAQ

What are the physical and chemical properties of 1-[1-(4-Chlorophenyl)cyclobutyl]-3-methyl-1-butanamine (CAS: 84467-54-9)?

1-[1-(4-Chlorophenyl)cyclobutyl]-3-methyl-1-butanamine is a crystalline compound with a molecular weight of approximately 265.16 g/mol. It has a low solubility in water but is soluble in organic solvents like ethanol and acetone. The compound exhibits mild reactivity under normal conditions, but caution should be exercised in acidic or basic media. It decomposes above its boiling point of 150°C.

How is 1-[1-(4-Chlorophenyl)cyclobutyl]-3-methyl-1-butanamine (CAS: 84467-54-9) typically synthesized?

1-[1-(4-Chlorophenyl)cyclobutyl]-3-methyl-1-butanamine is usually synthesized via a multi-step process involving the coupling of 4-chlorophenylcyclobutylamine with 3-methyl-1-butanone under acidic conditions. The reaction typically proceeds with a yield of around 80%, and the use of a suitable catalyst like titanium(IV) isopropoxide can enhance the selectivity and yield. The product undergoes purification through column chromatography.

What industries use 1-[1-(4-Chlorophenyl)cyclobutyl]-3-methyl-1-butanamine (CAS: 84467-54-9)?

1-[1-(4-Chlorophenyl)cyclobutyl]-3-methyl-1-butanamine is used in the pharmaceutical industry for the development of certain medications. It is also applied in the polymer industry for specialized polymer modifications. Additionally, it finds uses in the production of sensors and semiconductors due to its unique chemical properties.

What precautions should be taken when handling 1-[1-(4-Chlorophenyl)cyclobutyl]-3-methyl-1-butanamine (CAS: 84467-54-9)?

When handling 1-[1-(4-Chlorophenyl)cyclobutyl]-3-methyl-1-butanamine, it is essential to use personal protective equipment (PPE) such as gloves, goggles, and a lab coat. The compound should be stored in a cool, dry place away from direct sunlight. Fume hoods should be used during preparation to minimize inhalation risks. In case of a spill, it should be carefully cleaned up using appropriate absorbent materials and the incident should be reported. The safety data sheet (SDS) should always be referenced for detailed information.