Ethyl 1-methyl-1H-pyrrole-3-carboxylate | CAS No. 68384-82-7

Ethyl 1-methyl-1H-pyrrole-3-carboxylate

Basic Information

CAS Number

68384-82-7

Molecular Formula

C8H11NO2

Molecular Weight

153.18 g/mol

AD

Basic Physical Properties

CCOC(=O)C1=CN(C=C1)C

InChI

InChI=1S/C8H11NO2/c1-3-11-8(10)7-4-5-9(2)6-7/h4-6H,3H2,1-2H3

InChIKey

JXPPCMXKWJXYGS-UHFFFAOYSA-N

LogP

1.2018

Topological Polar Surface Area

31.23 Ų

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

147

Synonyms & References

English

  • Ethyl 1-methylpyrrole-3-carboxylate
  • AKOS006307713
  • AMY9317
  • Ethyl1-methyl-1H-pyrrole-3-carboxylate
  • Ethyl 1-methyl-1H-pyrrole-3-carboxylate
  • Z1198315028
  • 68384-82-7
  • MFCD11111732
  • CS-0298966
  • AC6616
  • SCHEMBL6657285
  • JXPPCMXKWJXYGS-UHFFFAOYSA-N
  • SB63453
  • SY224497
  • A915320
  • ethyl 1-methyl-3-pyrrolecarboxylate
  • 1H-Pyrrole-3-carboxylicacid,1-methyl-,ethylester(9CI)

MDL Number

MFCD11111732

FAQ

What are the physical and chemical properties of Ethyl 1-methyl-1H-pyrrole-3-carboxylate (CAS: 68384-82-7)?

Ethyl 1-methyl-1H-pyrrole-3-carboxylate is a colorless liquid with a molecular weight of approximately 160.22 g/mol. It is poorly soluble in water but miscible with most organic solvents. The compound is moderately reactive, particularly with strong bases and nucleophiles. It can be stored in a cool, dark place away from heat sources.

How is Ethyl 1-methyl-1H-pyrrole-3-carboxylate (CAS: 68384-82-7) typically synthesized?

Ethyl 1-methyl-1H-pyrrole-3-carboxylate can be synthesized via the reaction of ethyl acetoacetate with ethyl isocyanide in the presence of a Lewis acid catalyst such as aluminum chloride. The reaction yields the product with good selectivity and high yield.

What industries use Ethyl 1-methyl-1H-pyrrole-3-carboxylate (CAS: 68384-82-7)?

Ethyl 1-methyl-1H-pyrrole-3-carboxylate is used in the pharmaceutical industry for the synthesis of certain APIs and in the chemical industry for the production of various organic compounds. It also finds applications in the polymer industry for modifying polymer properties.

What precautions should be taken when handling Ethyl 1-methyl-1H-pyrrole-3-carboxylate (CAS: 68384-82-7)?

When handling Ethyl 1-methyl-1H-pyrrole-3-carboxylate, appropriate personal protective equipment (PPE) should be worn, including gloves, safety glasses, and a lab coat. The compound should be handled in a well-ventilated area or fume hood to minimize inhalation risk. Spills should be cleaned up carefully, and the material safety data sheet (MSDS) should be consulted for detailed instructions.

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