2-Phenylpiperidin-4-one hydrochloride

Basic Information

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CAS Number

1245648-13-8

Molecular Formula

C11H14ClNO

Molecular Weight

211.69 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

SMILES

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C1CNC(CC1=O)C2=CC=CC=C2.Cl

InChI

InChI=1S/C11H13NO.ClH/c13-10-6-7-12-11(8-10)9-4-2-1-3-5-9;/h1-5,11-12H,6-8H2;1H

InChIKey

QFGWZXKRGKBJQR-UHFFFAOYSA-N

LogP

2.102

Topological Polar Surface Area

29.1 Å²

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

185

Synonyms & References

English

2-Phenyl-piperidin-4-one hydrochloride
s11348
EN300-220798
MFCD11100370
2-Phenylpiperidin-4-one HCl
1245648-13-8
2-phenylpiperidin-4-onehydrochloride
2-phenylpiperidin-4-one;hydrochloride
2-Phenyl-4-piperidinone-hydrochloride
J-510254
2-phenylpiperidin-4-one hydrochloride
4-Piperidinone, 2-phenyl-, hydrochloride (1:1)

MDL Number

MFCD11100370

FAQ

What are the physical and chemical properties of 2-Phenylpiperidin-4-one hydrochloride (CAS: 1245648-13-8)?

2-Phenylpiperidin-4-one hydrochloride is a white crystalline solid with a molecular weight of approximately 265.68 g/mol. It is soluble in water and ethanol. The compound is relatively stable but can react with bases. Its solubility in water is 10 g/L at 25°C.

How is 2-Phenylpiperidin-4-one hydrochloride (CAS: 1245648-13-8) typically synthesized?

2-Phenylpiperidin-4-one hydrochloride can be synthesized by the condensation of piperidine-4-one with phenyl isocyanate, followed by hydrochlorination. The reaction typically yields 90% purity with good selectivity, and common catalysts include triethylamine and dichloromethane.

What industries use 2-Phenylpiperidin-4-one hydrochloride (CAS: 1245648-13-8)?

2-Phenylpiperidin-4-one hydrochloride is primarily used in the pharmaceutical industry for the synthesis of various drugs and intermediates. It also finds applications in the polymer industry for the modification of polymer properties and in the sensor industry for use as a chromogenic reagent.

What precautions should be taken when handling 2-Phenylpiperidin-4-one hydrochloride (CAS: 1245648-13-8)?

When handling 2-Phenylpiperidin-4-one hydrochloride, it is important to use personal protective equipment such as gloves, goggles, and a lab coat. The substance should be handled in a well-ventilated area or a fume hood. Spills should be cleaned up using appropriate absorbent materials, and the area should be thoroughly rinsed with water. Always refer to the Safety Data Sheet (SDS) for detailed handling information.