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5-Bromo-1H-benzimidazole-2-carboxylic acid ethyl ester is a chemical compound with the molecular formula C9H8BrN3O2. It is a benzimidazole derivative featuring a bromine atom attached to the benzene ring, known for its versatile reactivity and structural properties. 5-BROMO-1H-BENZIMIDAZOLE-2-CARBOXYLIC ACID ETHYL ESTER serves as a valuable building block in the synthesis of pharmaceuticals and agrochemicals, and also exhibits potential as a ligand in coordination chemistry and a therapeutic agent, particularly in oncology.

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  • 144167-50-0 Structure
  • Basic information

    1. Product Name: 5-BROMO-1H-BENZIMIDAZOLE-2-CARBOXYLIC ACID ETHYL ESTER
    2. Synonyms: 5-BROMO-1H-BENZIMIDAZOLE-2-CARBOXYLIC ACID ETHYL ESTER;ethyl 5-bromo-1H-benzimidazole-2-carboxylate;Ethyl 5-broMo-1H-benzo[d]iMidazole-2-carboxylate;1H-Benzimidazole-2-carboxylic acid,6-bromo-,ethyl ester;5-bromo-1H-benzo[d]imidazole-2-carboxylate;6-Bromo-1H-benzoimidazole-2-carboxylic acid ethyl ester;ethyl 5-bromobenzimidazole-2-carboxylate
    3. CAS NO:144167-50-0
    4. Molecular Formula: C10H9BrN2O2
    5. Molecular Weight: 269.09
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 144167-50-0.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 403.351 °C at 760 mmHg
    3. Flash Point: 197.74 °C
    4. Appearance: /
    5. Density: 1.624 g/cm3
    6. Vapor Pressure: 0mmHg at 25°C
    7. Refractive Index: 1.654
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. CAS DataBase Reference: 5-BROMO-1H-BENZIMIDAZOLE-2-CARBOXYLIC ACID ETHYL ESTER(CAS DataBase Reference)
    11. NIST Chemistry Reference: 5-BROMO-1H-BENZIMIDAZOLE-2-CARBOXYLIC ACID ETHYL ESTER(144167-50-0)
    12. EPA Substance Registry System: 5-BROMO-1H-BENZIMIDAZOLE-2-CARBOXYLIC ACID ETHYL ESTER(144167-50-0)
  • 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: 144167-50-0(Hazardous Substances Data)

144167-50-0 Usage

Uses

Used in Pharmaceutical and Agrochemical Synthesis:
5-BROMO-1H-BENZIMIDAZOLE-2-CARBOXYLIC ACID ETHYL ESTER is used as a building block for the synthesis of various pharmaceuticals and agrochemicals, leveraging its versatile reactivity and structural properties to create a wide range of bioactive compounds.
Used in Coordination Chemistry:
In the field of coordination chemistry, 5-BROMO-1H-BENZIMIDAZOLE-2-CARBOXYLIC ACID ETHYL ESTER is used as a ligand, forming complexes with various metal ions to explore new chemical and physical properties, as well as potential applications in catalysis, sensing, and materials science.
Used in Oncology Research and Therapeutics:
5-BROMO-1H-BENZIMIDAZOLE-2-CARBOXYLIC ACID ETHYL ESTER is used as a potential therapeutic agent in oncology, where it may contribute to the development of new treatments for various types of cancer. Its specific role in this field is still under investigation, but its structural features make it a promising candidate for further research and development.
Used in Medicinal Chemistry and Chemical Research:
5-BROMO-1H-BENZIMIDAZOLE-2-CARBOXYLIC ACID ETHYL ESTER is utilized in medicinal chemistry and chemical research for the exploration of its chemical properties, reactivity, and potential applications in drug discovery and development. Its unique structure and reactivity make it an important compound for advancing scientific understanding and creating innovative solutions in these fields.

Check Digit Verification of cas no

The CAS Registry Mumber 144167-50-0 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,4,4,1,6 and 7 respectively; the second part has 2 digits, 5 and 0 respectively.
Calculate Digit Verification of CAS Registry Number 144167-50:
(8*1)+(7*4)+(6*4)+(5*1)+(4*6)+(3*7)+(2*5)+(1*0)=120
120 % 10 = 0
So 144167-50-0 is a valid CAS Registry Number.
InChI:InChI=1/C10H9BrN2O2/c1-2-15-10(14)9-12-7-4-3-6(11)5-8(7)13-9/h3-5H,2H2,1H3,(H,12,13)

144167-50-0SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 19, 2017

Revision Date: Aug 19, 2017

1.Identification

1.1 GHS Product identifier

Product name ethyl 6-bromo-1H-benzimidazole-2-carboxylate

1.2 Other means of identification

Product number -
Other names ethyl 5-bromo-1H-benzimidazole-2-carboxylate

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:144167-50-0 SDS

144167-50-0Downstream Products

144167-50-0Relevant articles and documents

INHIBITORS OF LOW MOLECULAR WEIGHT PROTEIN TYROSINE PHOSPHATASE (LMPTP) AND USES THEREOF

-

, (2018/11/26)

Protein tyrosine phosphatases (PTPs) are key regulators of metabolism and insulin signaling. As a negative regulator of insulin signaling, the low molecular weight protein tyrosine phosphatase (LMPTP) is a target for insulin resistance and related conditions. Described herein are compounds capable of modulating the level of activity of low molecular weight protein tyrosine phosphatase (LMPTP) and compositions, and methods of using these compounds and compositions.

INHIBITORS OF BRUTON'S TYROSINE KINASE

-

, (2015/06/25)

This application discloses compounds according to generic Formula (I) wherein all variables are defined as described herein, which inhibit Btk. The compounds disclosed herein are useful to modulate the activity of Btk and treat diseases associated with ex

Reactions of hydroxylamines with ethyl cyanoformate. Preparation of aminonitrones and their synthetic applications

Branco,Prabhakar,Lobo,Williams

, p. 6335 - 6360 (2007/10/02)

The reaction of hydroxylamines with ethyl cyanoformate 1 leads to the formation of carbethoxyamino nitrones. 2. UV spectroscopy provided information that suggested the nitrone structure for these compounds in solution. X-ray analysis of 2a confirmed that it exists entirely in the nitrone form in the solid state. These nitrones are shown to be excellent starting materials for a variety of nitrogen containing compounds, namely, imidazoles, benzimidazoles, benzimidazolones, oxadiazolones, N-arylamidines and quinoxalone.

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