Ethyl 1-methyl-4-phenyl-4-piperidinecarboxylate hydrochloride (1:1) | CAS No. 50-13-5

Ethyl 1-methyl-4-phenyl-4-piperidinecarboxylate hydrochloride (1:1)

Basic Information

CAS Number

50-13-5

Molecular Formula

C15H22ClNO2

Molecular Weight

283.8 g/mol

AD

Basic Physical Properties

Melting Point

186-189°

Boiling Point

282°C (rough estimate)

Flash Point

11 °C

Refractive Index

1.5200 (estimate)

CCOC(=O)C1(CCN(CC1)C)C2=CC=CC=C2.Cl

InChI

InChI=1S/C15H21NO2.ClH/c1-3-18-14(17)15(9-11-16(2)12-10-15)13-7-5-4-6-8-13;/h4-8H,3,9-12H2,1-2H3;1H

InChIKey

WCNLCIJMFAJCPX-UHFFFAOYSA-N

LogP

2.6349000000000014

Topological Polar Surface Area

29.54 Ų

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

276

Safety Information

View Safety Information

Hazard Class

Class 6.1(b) Class 6.1(b)

Toxicity

LD50 orally in rats: 170 mg/kg (Barlow, Lewis)

Synonyms & References

English

  • PETHIDINE HYDROCHLORIDE (EP IMPURITY)
  • Dolantin hydrochloride
  • PETHIDINE HYDROCHLORIDE [EP MONOGRAPH]
  • Pethidine chloride
  • NSC 400479
  • Dolopethin
  • Pethidine Hydrochloride (Meperidine Hydrochloride)
  • Petisel
  • Isonipecotic acid, 1-methyl-4-phenyl-, ethyl ester, hydrochloride
  • Meperidine hydrochloride (USP)
  • 50-13-5 (HCl)
  • Cluyer
  • Pethidine hydrochloride
  • Spasmedal
  • MEPERIDINE HYDROCHLORIDE [USP MONOGRAPH]
  • D01383
  • Isonipecaine hydrochloride
  • Dolantol
  • Ethyl 1-methyl-4-phenylpiperidine-4-carboxylate monohydrochloride
  • Meperidine hydrochloride (USAN:USP)
  • Sauteralgyl
  • MEPERIDINE HYDROCHLORIDE [VANDF]
  • Ethyl-1-methyl-4-phenylisonipecotate hydrochloride
  • MEPERIDINE HYDROCHLORIDE [USAN]
  • NSC400479
  • Dolargan
  • Dolosal
  • ethyl 1-methyl-4-phenylpiperidine-4-carboxylate;hydrochloride
  • 1-Methyl-4-phenylisonipecotic acid ethyl ester hydrochloride
  • CHEMBL1701
  • Synelaudine

FAQ

What are the physical and chemical properties of Ethyl 1-methyl-4-phenyl-4-piperidinecarboxylate hydrochloride (CAS: 50-13-5)?

Ethyl 1-methyl-4-phenyl-4-piperidinecarboxylate hydrochloride is a white crystalline solid with a molecular weight of approximately 316.36 g/mol. It has a pKa of about 4.5 and is soluble in water and organic solvents like ethanol and methanol. This compound is reactive and susceptible to hydrolysis under acidic or basic conditions.

How is Ethyl 1-methyl-4-phenyl-4-piperidinecarboxylate hydrochloride (CAS: 50-13-5) typically synthesized?

Ethyl 1-methyl-4-phenyl-4-piperidinecarboxylate hydrochloride is synthesized by reacting 1-methyl-4-phenyl-4-piperidinecarboxylic acid with ethyl chloroformate in the presence of a base such as triethylamine. The reaction is typically carried out at room temperature, and the product is isolated by recrystallization from a suitable solvent.

What industries use Ethyl 1-methyl-4-phenyl-4-piperidinecarboxylate hydrochloride (CAS: 50-13-5)?

Ethyl 1-methyl-4-phenyl-4-piperidinecarboxylate hydrochloride finds applications in the pharmaceutical industry as an intermediate in the synthesis of certain drugs. It is also used in the polymer industry for modifying properties of polymers and in the sensor industry for developing chemical sensors due to its reactivity and specific functional groups.

What precautions should be taken when handling Ethyl 1-methyl-4-phenyl-4-piperidinecarboxylate hydrochloride (CAS: 50-13-5)?

When handling Ethyl 1-methyl-4-phenyl-4-piperidinecarboxylate hydrochloride, it is essential to wear proper personal protective equipment (PPE) including gloves, safety goggles, and a lab coat. Store the compound in a cool, dry place away from direct sunlight. Use a fume hood during handling to minimize exposure to vapors. In case of a spill, immediately clean it up and refer to the Safety Data Sheet (SDS) for specific spill cleanup procedures.

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