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1H-Pyrrolo[3,2-c]pyridine-1-carboxylic acid,2,3-dihydro-1,1-dimethylethyl ester is an organic compound characterized by its molecular formula C14H17NO3. It is an ester derivative of carboxylic acid, featuring two methyl groups attached to the nitrogen atom. This colorless to pale yellow liquid exhibits a fruity odor and is insoluble in water but readily soluble in organic solvents. Commonly utilized as a reagent in chemical synthesis and pharmaceutical research, its applications extend to the production of pharmaceutical drugs, agrochemicals, and the synthesis of other organic compounds. Due to its potential hazards if mishandled, careful handling is advised.

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  • 219834-81-8 Structure
  • Basic information

    1. Product Name: 1H-Pyrrolo[3,2-c]pyridine-1-carboxylic acid,2,3-dihydro-1,1-diemthylethyl ester
    2. Synonyms: 1H-Pyrrolo[3,2-c]pyridine-1-carboxylic acid,2,3-dihydro-1,1-diemthylethyl ester;tert-butyl 2,3-dihydro-1H-pyrrolo[3,2-c]pyridine-1-carboxylate;1H-Pyrrolo[3,2-c]pyridine-1-carboxylic acid;1H-PYRROLO[3,2-C]PYRIDINE-1-CARBOXYLIC ACID, 2,3-DIHYDRO-, 1,1-DIMETHYLETHYL ESTER
    3. CAS NO:219834-81-8
    4. Molecular Formula: C12H16N2O2
    5. Molecular Weight: 220.27
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 219834-81-8.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: N/A
    3. Flash Point: N/A
    4. Appearance: /
    5. Density: N/A
    6. Refractive Index: N/A
    7. Storage Temp.: 2-8°C
    8. Solubility: N/A
    9. CAS DataBase Reference: 1H-Pyrrolo[3,2-c]pyridine-1-carboxylic acid,2,3-dihydro-1,1-diemthylethyl ester(CAS DataBase Reference)
    10. NIST Chemistry Reference: 1H-Pyrrolo[3,2-c]pyridine-1-carboxylic acid,2,3-dihydro-1,1-diemthylethyl ester(219834-81-8)
    11. EPA Substance Registry System: 1H-Pyrrolo[3,2-c]pyridine-1-carboxylic acid,2,3-dihydro-1,1-diemthylethyl ester(219834-81-8)
  • 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: 219834-81-8(Hazardous Substances Data)

219834-81-8 Usage

Uses

Used in Pharmaceutical Research and Development:
1H-Pyrrolo[3,2-c]pyridine-1-carboxylic acid,2,3-dihydro-1,1-dimethylethyl ester is used as a reagent in pharmaceutical research and development for its ability to contribute to the synthesis of various drug compounds. Its unique structure allows it to be a key component in the creation of new pharmaceutical entities.
Used in Agrochemical Production:
In the agrochemical industry, 1H-Pyrrolo[3,2-c]pyridine-1-carboxylic acid,2,3-dihydro-1,1-dimethylethyl ester is used as a precursor in the synthesis of agrochemicals, playing a crucial role in the development of pesticides and other agricultural chemicals that protect crops and enhance yields.
Used in Organic Synthesis:
1H-Pyrrolo[3,2-c]pyridine-1-carboxylic acid,2,3-dihydro-1,1-dimethylethyl ester is utilized as an intermediate in organic synthesis, enabling the production of a wide range of organic compounds for various applications across different industries. Its versatility in chemical reactions makes it a valuable asset in the synthesis of complex organic molecules.

Check Digit Verification of cas no

The CAS Registry Mumber 219834-81-8 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 2,1,9,8,3 and 4 respectively; the second part has 2 digits, 8 and 1 respectively.
Calculate Digit Verification of CAS Registry Number 219834-81:
(8*2)+(7*1)+(6*9)+(5*8)+(4*3)+(3*4)+(2*8)+(1*1)=158
158 % 10 = 8
So 219834-81-8 is a valid CAS Registry Number.

219834-81-8SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 17, 2017

Revision Date: Aug 17, 2017

1.Identification

1.1 GHS Product identifier

Product name tert-butyl 2,3-dihydropyrrolo[3,2-c]pyridine-1-carboxylate

1.2 Other means of identification

Product number -
Other names -

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:219834-81-8 SDS

219834-81-8Relevant articles and documents

HETEROCYCLIC COMPOUNDS AND THEIR USE FOR TREATMENT OF HELMINTHIC INFECTIONS AND DISEASES

-

, (2020/11/03)

Provided herein are Heterocyclic compounds of formula (I): and pharmaceutically acceptable salts, tautomers, isotopologues, or stereoisomers thereof, wherein W, X, Y, R1, R2, and RN are as defined herein, compositions comprising an effective amount of a Heterocyclic Compound, and methods for treating or preventing animal and human filarial worm infections and diseases.

Configurationally Stable Biaryl Analogues of 4-(Dimethylamino)pyridine: A Novel Class of Chiral Nucleophilic Catalysts

Spivey, Alan C.,Fekner, Tomasz,Spey, Sharon E.,Adams, Harry

, p. 9430 - 9443 (2007/10/03)

A short synthetic approach toward a novel class of chiral nucleophilic catalysts, the dissymmetry of which stems from restricted rotation about an Ar-Ar bond, has been developed. The key steps of the synthesis include preparation of a nucleophilic 1-methyl-2-pyrrolino[3,2-c]pyridine core 16 by ortho-lithiation and creation of the biaryl axes via Suzuki cross-coupling reactions. Comparative HPLC studies of racemization for configurationally labile biaryls 31, 38, and 43 containing 1-methyl-2-pyrrolino[3,2-c]pyridine, 4-(dimethylamino)pyridine, and 4-(1-pyrrolidino)pyridine cores, respectively, have demonstrated that a pyrrolidino substituent ortho to the biaryl axis is optimal for slowing Ar-Ar rotation. Biaryls containing all three cores have been shown to retain DMAP-like catalytic activity in the acylation of a hindered alcohol. Biaryls 55 and 56, which are configurationally stable at ambient temperature, have also been prepared via modification of configurationally labile derivatives. Compounds 55 and 56 in optically pure form should provide a useful starting point for studies on catalytic asymmetric acyl transfer using atropisomeric analogues of DMAP.

Synthesis of atropisomeric analogues of DMAP

Spivey, Alan C.,Fekner, Tomasz,Adams, Harry

, p. 8919 - 8922 (2007/10/03)

A method for the preparation of 7-aryl derivatives of N-methyl-5- azaindolinee involving Suzuki cross-coupling is described. Certain biaryls prepared in this manner exhibit atropisomerism. In particular, azaindoline 11 is shown to be configurationally sta

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