4-(Aminomethyl)-1-benzyl-4-piperidinol

Basic Information

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CAS Number

23804-68-4

Molecular Formula

C13H20N2O

Molecular Weight

220.32 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

SMILES

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NCC1(O)CCN(Cc2ccccc2)CC1

InChI

InChI=1S/C13H20N2O/c14-11-13(16)6-8-15(9-7-13)10-12-4-2-1-3-5-12/h1-5,16H,6-11,14H2

InChIKey

IWYHVVSOLJTLRK-UHFFFAOYSA-N

LogP

0.9721999999999997

Topological Polar Surface Area

49.49 Å²

Hydrogen Bond Donor/Acceptor

3 / 3

Synonyms & References

English

4-(aminomethyl)-1-benzylpiperidin-4-ol
1-benzyl-4-aminomethyl-4-piperidinol
1-benzyl-4-hydroxy-4-aminomethyl piperidine
4-(aminomethyl)-1-benzyl-4-hydroxypiperidine
4-(aminomethyl)-1-benzyl-4-piperidinol
4-(aminomethyl)-1-phenylmethyl-4-piperidinol
4-Aminomethyl-1-benzyl-piperidin-4-ol

MDL Number

MFCD06213099

Customs Code

2933399090

FAQ

What are the physical and chemical properties of 4-(Aminomethyl)-1-benzyl-4-piperidinol (CAS: 23804-68-4)?

4-(Aminomethyl)-1-benzyl-4-piperidinol (CAS: 23804-68-4) is a white to off-white crystalline solid with a molecular weight of approximately 264.35 g/mol. It is moderately soluble in water and polar organic solvents. This compound is reactive, particularly towards nucleophiles, making it useful in various chemical transformations. It has a pKa of 9.9, indicating basic properties.

How is 4-(Aminomethyl)-1-benzyl-4-piperidinol (CAS: 23804-68-4) typically synthesized?

4-(Aminomethyl)-1-benzyl-4-piperidinol (CAS: 23804-68-4) can be synthesized via alkylation of 4-hydroxypiperidine with benzylamine followed by amination with methylamine. The key steps involve careful control of reaction conditions to achieve high yield and selectivity. Commonly used catalysts include triethylamine and pyridine, ensuring a safe and effective synthesis process.

What industries use 4-(Aminomethyl)-1-benzyl-4-piperidinol (CAS: 23804-68-4)?

4-(Aminomethyl)-1-benzyl-4-piperidinol (CAS: 23804-68-4) finds applications in pharmaceuticals, where it serves as a building block for drug synthesis. It is also used in the polymer industry for functionalizing polymers and in the development of sensors for detecting specific analytes. Its reactivity makes it valuable in semiconductor manufacturing as a dopant or surface modifier.

What precautions should be taken when handling 4-(Aminomethyl)-1-benzyl-4-piperidinol (CAS: 23804-68-4)?

When handling 4-(Aminomethyl)-1-benzyl-4-piperidinol (CAS: 23804-68-4), it is essential to use personal protective equipment (PPE) such as gloves, goggles, and lab coats. Work should be conducted in a well-ventilated area or a fume hood. Spills should be cleaned up immediately using appropriate absorbent materials. Always consult a Material Safety Data Sheet (MSDS) or Safety Data Sheet (SDS) for detailed handling and emergency procedures.