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1H-Pyrrolo[2,3-b]pyridine-3-carboxylic acid, methyl ester is a heterocyclic chemical compound with the molecular formula C11H9NO2. It is a methyl ester derivative of pyrrolopyridine carboxylic acid, known for its potential as a building block in the synthesis of pharmaceuticals and agrochemicals. Its unique structure and properties make it a valuable intermediate in the production of drugs and other organic compounds, with applications in medicinal chemistry and drug development.

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  • 808137-94-2 Structure
  • Basic information

    1. Product Name: 1H-Pyrrolo[2,3-b]pyridine-3-carboxylic acid, methyl ester
    2. Synonyms: Methyl 1H-pyrrolo[2,3-b]pyridine-3-carbo×ylate;Methyl 1H-pyrrolo[2,3-b]pyridine-3-carboxylate, 3-(Methoxycarbonyl)-1H-pyrrolo[2,3-b]pyridine;1H-Pyrrolo[2,3-b]pyridine-3-carboxylic acid, methyl ester;Methyl 1H-pyrrolo[2,3-b]pyridine-3-carboxylate;Methyl 7-azaindole-3-carboxylate;Methyl 7-azaindole-3-carb...
    3. CAS NO:808137-94-2
    4. Molecular Formula: C9H8N2O2
    5. Molecular Weight: 176.18
    6. EINECS: N/A
    7. Product Categories: Heterocycle-Pyridine series
    8. Mol File: 808137-94-2.mol
  • Chemical Properties

    1. Melting Point: 57-59℃
    2. Boiling Point: N/A
    3. Flash Point: N/A
    4. Appearance: /
    5. Density: 1.324
    6. Refractive Index: 1.648
    7. Storage Temp.: Sealed in dry,Room Temperature
    8. Solubility: N/A
    9. PKA: 12.30±0.40(Predicted)
    10. CAS DataBase Reference: 1H-Pyrrolo[2,3-b]pyridine-3-carboxylic acid, methyl ester(CAS DataBase Reference)
    11. NIST Chemistry Reference: 1H-Pyrrolo[2,3-b]pyridine-3-carboxylic acid, methyl ester(808137-94-2)
    12. EPA Substance Registry System: 1H-Pyrrolo[2,3-b]pyridine-3-carboxylic acid, methyl ester(808137-94-2)
  • 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: 808137-94-2(Hazardous Substances Data)

808137-94-2 Usage

Uses

Used in Pharmaceutical Industry:
1H-Pyrrolo[2,3-b]pyridine-3-carboxylic acid, methyl ester is used as a key intermediate for the synthesis of various pharmaceuticals. Its heterocyclic structure allows for the development of novel chemical entities with potential therapeutic applications, contributing to the discovery of new drugs and treatments.
Used in Agrochemical Industry:
In the agrochemical sector, 1H-Pyrrolo[2,3-b]pyridine-3-carboxylic acid, methyl ester serves as a crucial building block for the synthesis of agrochemicals. Its properties enable the creation of new compounds with pesticidal or herbicidal activities, enhancing crop protection and yield.
Used in Medicinal Chemistry Research:
1H-Pyrrolo[2,3-b]pyridine-3-carboxylic acid, methyl ester is utilized as a starting material in medicinal chemistry research. Its ability to form diverse chemical entities makes it a valuable tool for exploring new biological activities and potential drug candidates, advancing the field of drug development.

Check Digit Verification of cas no

The CAS Registry Mumber 808137-94-2 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 8,0,8,1,3 and 7 respectively; the second part has 2 digits, 9 and 4 respectively.
Calculate Digit Verification of CAS Registry Number 808137-94:
(8*8)+(7*0)+(6*8)+(5*1)+(4*3)+(3*7)+(2*9)+(1*4)=172
172 % 10 = 2
So 808137-94-2 is a valid CAS Registry Number.
InChI:InChI=1/C9H8N2O2/c1-13-9(12)7-5-11-8-6(7)3-2-4-10-8/h2-5H,1H3,(H,10,11)

808137-94-2 Well-known Company Product Price

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  • Alfa Aesar

  • (H34248)  Methyl 7-azaindole-3-carboxylate, 95%   

  • 808137-94-2

  • 250mg

  • 1343.0CNY

  • Detail
  • Alfa Aesar

  • (H34248)  Methyl 7-azaindole-3-carboxylate, 95%   

  • 808137-94-2

  • 1g

  • 3734.0CNY

  • Detail

808137-94-2SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 20, 2017

Revision Date: Aug 20, 2017

1.Identification

1.1 GHS Product identifier

Product name 1H-Pyrrolo[2,3-b]Pyridine-3-Carboxylic Acid, Methyl Ester

1.2 Other means of identification

Product number -
Other names methyl 1H-pyrrolo[2,3-b]pyridine-3-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:808137-94-2 SDS

808137-94-2Relevant articles and documents

Synthetic method for 7-azaindole-3-methyl formate

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, (2017/08/28)

The invention discloses a synthetic method for 7-azaindole-3-methyl formate, and belongs to the field of organic synthesis. The method comprises the steps of reacting 2-amino-3-bromopyridine as a reactant with 3-hydroxyl acrylonitrile metal salt in an acidic environment to synthesize 3-(3-bromopyridine-2-yl-amino) acrylonitrile; adding 3-(3-bromopyridine-2-yl-amino) acrylonitrile, alkali and a catalysis system to a solvent, and performing a reaction to generate 3-cyano-7-azaindole; and finally performing a reaction in the presence of methanol and hydrochloric acid to obtain 7-azaindole-3-methyl formate. According to the method, the raw materials are low in price and easy to obtain, the reaction steps are simple, the reaction conditions are mild, the product quality is stable, and the purity is high; and therefore, the method is suitable for industrial production.

Synthesis process of 1H-pyrrolo[2,3-B] pyridine-3-carboxylic methyl ether

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Paragraph 0017; 0018, (2017/01/09)

The invention relates to a synthesis process of 1H-pyrrolo[2,3-B] pyridine-3-carboxylic methyl ether. The 1H-pyrrolo[2,3-B] pyridine-3-carboxylic methyl ether is obtained by the following steps: adding 1H-pyrrolo[2,3-B] pyridine-3-carboxylic acid and methanol to a three-mouth flask; firstly heating the three-mouth flask at 35-58 DEG C for 10-25 minutes, and adding a mixture prepared from anhydrous calcium chloride and nano-aluminum oxide as a catalyst; carrying out heating reflux at 45-62 DEG C for 25-60 minutes, carrying out esterification reaction, cooling to a room temperature, filtering and evaporating excessive methanol from the filtrate at a temperature not higher than 65 DEG C at reduced pressure, so as to obtain the 1H-pyrrolo[2,3-B] pyridine-3-carboxylic methyl ether. The adopted catalyst is convenient to operate when used, and is free of corrosivity or strong irritating smell, low in demands on hardware such as equipment, and beneficial to physical health of environmental personnel and operating personnel; the treatment after reaction is simple; the catalyst is low in price, available, low in cost and beneficial to large-scale application in industry.

[4[4-(5-AMINOMETHYL-2-FLUORO-PHENYL)-PIPERIDIN-1-YL]-(1H-PYRROLO-PYRIDIN-YL)-METHANONES AND SYNTHESIS THEREOF

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Page/Page column 80; 81, (2011/07/09)

The present invention relates herein to compounds and compositions for the treatment and amelioration of inflammatory disease. Specifically the present invention relates to compounds that having a tryptase inhibition activity and the intermediates thereof, pharmaceutical compositions comprising such compounds, and a method of treating subjects suffering from a condition disease or disorder that can be ameliorated by the administration of an inhibitor of tryptase including but not limited to for example asthma and other inflammatory diseases including age-related macular degeneration.

Desulfonylation of indoles and 7-azaindoles using sodium tert-butoxide

Chaulet, Charlotte,Croix, Cécile,Basset, Joan,Pujol, Maria-Dolores,Viaud-Massuard, Marie-Claude

experimental part, p. 1481 - 1484 (2010/08/22)

A mild method for the desulfonylation of N-indoles and N-azaindoles is described. Deprotection is carried out under basic conditions, using sodium tert-butoxide in dioxane. Several functionalized indoles and 7-azaindoles were efficiently deprotected by this method, which is mild enough to be used to deprotect compounds including functions that are known to be sensitive to acidic or basic conditions.

PYRIDINONYL PDK1 INHIBITORS

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Page/Page column 93, (2008/06/13)

The present invention provides pyridinonyl PDKl inhibitors and methods of treating cancer using the same.

COMPOSITIONS USEFUL AS INHIBITORS OF PROTEIN KINASES

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Page/Page column 131-132, (2010/02/11)

The present invention relates to compounds useful of inhibitors of protein kinases. The invention also provides pharmaceutically acceptable compositions comprising said compounds and methods of using the compositions in the treatment of various disease, conditions, or disorders.

3-(GUANIDINOCARBONYL)HETEROCYCLE DERIVATIVES, PREPARATION PROCESS AND INTERMEDIATES OF THIS PROCESS, THEIR USE AS MEDICAMENTS, AND PHARMACEUTICAL COMPOSITIONS INCLUDING THEM

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Page 40, (2008/06/13)

The present invention relates to the novel compounds of the formula (I) and their pharmaceutically acceptable salts. The inventive compounds are suitable, for example, as antiarrhythmic medicaments with a cardioprotective component for infarction prophyla

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