Ethyl 5-benzyl-1H-1,2,4-triazole-3-carboxylate | CAS No. 648430-85-7

Ethyl 5-benzyl-1H-1,2,4-triazole-3-carboxylate

Basic Information

CAS Number

648430-85-7

Molecular Formula

C12H13N3O2

Molecular Weight

231.26 g/mol

AD

Basic Physical Properties

CCOC(=O)c1n[nH]c(Cc2ccccc2)n1

InChI

InChI=1S/C12H13N3O2/c1-2-17-12(16)11-13-10(14-15-11)8-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3,(H,13,14,15)

InChIKey

ZDYNKUMTNKZJGQ-UHFFFAOYSA-N

LogP

1.5722

Topological Polar Surface Area

67.87 Ų

Hydrogen Bond Donor/Acceptor

1 / 5

Complexity

254

Synonyms & References

English

  • Ethyl 5-benzyl-4H-1,2,4-triazole-3-carboxylate
  • ETHYL 5-BENZYL-1H-1,2,4-TRIAZOLE-3-CARBOXYLATE
  • 1H-1,2,4-Triazole-5-carboxylic acid, 3-(phenylmethyl)-, ethyl ester
  • ethyl 3-benzyl-1H-1,2,4-triazole-5-carboxylate
  • ZDYNKUMTNKZJGQ-UHFFFAOYSA-N
  • Z2070537475

MDL Number

MFCD30489512

FAQ

What is Ethyl 5-benzyl-1H-1,2,4-triazole-3-carboxylate (CAS: 648430-85-7)?

Ethyl 5-benzyl-1H-1,2,4-triazole-3-carboxylate (CAS: 648430-85-7) is an organic compound with a molecular formula of C13H12N4O3. It is a colorless or white crystalline solid with a characteristic odor. This compound is commonly used in pharmaceuticals and research due to its potential biological activities.

What are the main uses of Ethyl 5-benzyl-1H-1,2,4-triazole-3-carboxylate (CAS: 648430-85-7)?

Ethyl 5-benzyl-1H-1,2,4-triazole-3-carboxylate (CAS: 648430-85-7) is primarily used in the pharmaceutical industry as an intermediate for the synthesis of various drugs. It also has potential applications in research for its biological activities.

Is Ethyl 5-benzyl-1H-1,2,4-triazole-3-carboxylate (CAS: 648430-85-7) safe?

Ethyl 5-benzyl-1H-1,2,4-triazole-3-carboxylate (CAS: 648430-85-7) is generally considered safe under normal handling conditions. However, it is advisable to follow safety guidelines such as wearing appropriate personal protective equipment and ensuring proper ventilation during use. Immediate medical attention should be sought in case of accidental ingestion or contact with the eyes.

How should Ethyl 5-benzyl-1H-1,2,4-triazole-3-carboxylate (CAS: 648430-85-7) be stored?

Ethyl 5-benzyl-1H-1,2,4-triazole-3-carboxylate (CAS: 648430-85-7) should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed container and protected from moisture to maintain its stability. Storage temperature should be below 25°C to prevent degradation.

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