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Ethyl 5-benzyl-4H-1,2,4-triazole-3-carboxylate is an organic compound characterized by its molecular formula C14H14N4O2. It is a triazole derivative featuring a benzyl group attached to the 5-position of the triazole ring. Ethyl 5-benzyl-4H-1,2,4-triazole-3-carboxylate is recognized for its potential biological activity, particularly as an antifungal and antibacterial agent, and is frequently utilized as a building block in the synthesis of pharmaceuticals, agrochemicals, and other organic materials. Its structure and reactivity contribute to its value in the development of new compounds with potential therapeutic applications.

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  • 648430-85-7 Structure
  • Basic information

    1. Product Name: Ethyl 5-benzyl-4H-1,2,4-triazole-3-carboxylate
    2. Synonyms: 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
    3. CAS NO:648430-85-7
    4. Molecular Formula: C12H13N3O2
    5. Molecular Weight: 231.25052
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 648430-85-7.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 429.1±38.0 °C(Predicted)
    3. Flash Point: N/A
    4. Appearance: /
    5. Density: 1.230±0.06 g/cm3(Predicted)
    6. Refractive Index: N/A
    7. Storage Temp.: N/A
    8. Solubility: N/A
    9. PKA: 8.44±0.40(Predicted)
    10. CAS DataBase Reference: Ethyl 5-benzyl-4H-1,2,4-triazole-3-carboxylate(CAS DataBase Reference)
    11. NIST Chemistry Reference: Ethyl 5-benzyl-4H-1,2,4-triazole-3-carboxylate(648430-85-7)
    12. EPA Substance Registry System: Ethyl 5-benzyl-4H-1,2,4-triazole-3-carboxylate(648430-85-7)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 648430-85-7(Hazardous Substances Data)

648430-85-7 Usage

Uses

Used in Pharmaceutical Industry:
Ethyl 5-benzyl-4H-1,2,4-triazole-3-carboxylate is used as a building block for the synthesis of various pharmaceuticals due to its unique structure and reactivity, which allows for the creation of new compounds with potential therapeutic applications.
Used in Agrochemical Industry:
In the agrochemical industry, Ethyl 5-benzyl-4H-1,2,4-triazole-3-carboxylate is used as a precursor in the development of new agrochemicals, leveraging its antifungal and antibacterial properties to enhance crop protection and yield.
Used in Organic Synthesis:
Ethyl 5-benzyl-4H-1,2,4-triazole-3-carboxylate is used as a versatile intermediate in organic synthesis, enabling the production of a wide range of organic materials that can be applied across various industries.

Check Digit Verification of cas no

The CAS Registry Mumber 648430-85-7 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 6,4,8,4,3 and 0 respectively; the second part has 2 digits, 8 and 5 respectively.
Calculate Digit Verification of CAS Registry Number 648430-85:
(8*6)+(7*4)+(6*8)+(5*4)+(4*3)+(3*0)+(2*8)+(1*5)=177
177 % 10 = 7
So 648430-85-7 is a valid CAS Registry Number.

648430-85-7Upstream product

648430-85-7Downstream Products

648430-85-7Relevant articles and documents

Thio-seven-membered ring derivative and application thereof

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Paragraph 0121; 0124; 0137-0138, (2021/05/12)

The invention discloses a thio-seven-membered ring derivative or a pharmaceutical salt, a solvate, a stereoisomer and a racemate thereof. The structure of the thio-seven-membered ring derivative is shown as a general formula I, wherein the definition of e

INHIBITORS OF RECEPTOR INTERACTING PROTEIN KINASE I FOR THE TREATMENT OF DISEASE

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Paragraph 0556, (2021/03/13)

Disclosed herein are compounds which inhibit RIPK1, pharmaceutical compositions, and methods of treatment of RIPK1 -mediated diseases, such as neurodegenerative disorders, inflammatory disorders, and cancer.

HETEROCYCLES USEFUL AS INHIBITORS OF CARBONIC ANHYDRASE

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Page/Page column 52-53, (2008/06/13)

Sulfonamides and pharmaceutical compositions containing the compounds useful in controlling intraocular pressure are disclosed. Methods for controlling intraocular pressure through administration of the compositions are also disclosed.

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