N-benzyl-6-(4-phenylbutoxy)hexan-1-amine

Basic Information

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CAS Number

97664-55-6

Molecular Formula

C23H33NO

Molecular Weight

339.52 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Physical Properties

SMILES

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C1=CC=C(C=C1)CCCCOCCCCCCNCC2=CC=CC=C2

InChI

InChI=1S/C23H33NO/c1(10-18-24-21-23-16-7-4-8-17-23)2-11-19-25-20-12-9-15-22-13-5-3-6-14-22/h3-8,13-14,16-17,24H,1-2,9-12,15,18-21H2

InChIKey

JWLIKZBRVQRFNF-UHFFFAOYSA-N

LogP

5.376100000000005

Topological Polar Surface Area

21.259999999999998 Å²

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

282

Synonyms & References

English

N-Benzyl-6-(4-phenylbutoxy)hexan-1-amine
[6-(4-Phenylbutoxy)hexyl]benzylamine
2.N-(6-(4-PHENYL BUTOXY) HEXY) BENZENEAMINE
4-Phenylbutyric Acid-13C6
Benzenemethanamine, N-[6-(4-phenylbutoxy)hexyl]-
6-Benzylamino-1-(4'-phenylbutoxy)hexane
6-N-benzylamino-1-(4'-phenylbutoxy)hexane
benzyl(6-(4-pheylbutoxy)hexyl)amine
N-[6-(4-phenylbutoxy)hexyl]benzenemethanamine
N-benzyl-6-(4-phenylbutoxy)hexylamine
N-[6-(4-Phenylbutoxy)hexyl]benzenemethanamine (ACI)
1,13-Diphenyl-12-aza-5-oxatridecane
6-N-Benzylamino-1-(4'-phenylbutoxy)Hexane
DTXSID40448220
SB83545
JWLIKZBRVQRFNF-UHFFFAOYSA-N
AKOS016003681
N-benzyl-6-(4-phenylbutoxy)hexan-1-amine
BS-49596
N-[6-(4-Phenylbutoxy)hexyl]-benzenemethanamine
SCHEMBL456614
AC-25488
N-Benzyl-6-(4-phenylbutoxy)hexan-1-amine; N-[6-(4-phenylbutoxy)hexyl]-benzenemethanamine
97664-55-6
BENZYL[6-(4-PHENYLBUTOXY)HEXYL]AMINE

MDL Number

MFCD04118104

Customs Code

2922199090

FAQ

What are the physical and chemical properties of N-benzyl-6-(4-phenylbutoxy)hexan-1-amine (CAS: 97664-55-6)?

N-benzyl-6-(4-phenylbutoxy)hexan-1-amine is a crystalline solid with a molecular weight of approximately 344.42 g/mol. It has a high solubility in organic solvents such as ethanol and acetone but is only slightly soluble in water. Chemically, it is reactive towards acids and bases, making it useful in various chemical reactions. The compound is stable under normal conditions but should be stored away from strong acids and bases.

How is N-benzyl-6-(4-phenylbutoxy)hexan-1-amine (CAS: 97664-55-6) typically synthesized?

N-benzyl-6-(4-phenylbutoxy)hexan-1-amine is typically synthesized using a multistep process involving alkylation and amine coupling reactions. The synthesis usually begins with the preparation of a benzyl halide followed by the introduction of the 4-phenylbutyl moiety through a coupling reaction with an appropriate amine. The reaction is catalyzed using palladium or other transition metals, with a high yield and good selectivity.

What industries use N-benzyl-6-(4-phenylbutoxy)hexan-1-amine (CAS: 97664-55-6)?

N-benzyl-6-(4-phenylbutoxy)hexan-1-amine is used in the pharmaceutical industry for the synthesis of certain drug candidates. It is also utilized in the polymer industry for modifying polymer properties and in the sensor industry for developing gas-sensing materials. Additionally, it finds applications in the semiconductor industry due to its electronic properties.

What precautions should be taken when handling N-benzyl-6-(4-phenylbutoxy)hexan-1-amine (CAS: 97664-55-6)?

When handling N-benzyl-6-(4-phenylbutoxy)hexan-1-amine, it is important to use proper personal protective equipment (PPE) such as gloves, goggles, and a lab coat. The work should be conducted in a well-ventilated area or a fume hood to prevent inhalation. In case of a spill, neutralize any acids or bases with appropriate reagents and dispose of the material according to local regulations. Always refer to the Safety Data Sheet (SDS) for detailed handling and storage information.