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ETHYL 4-ACETYL-1H-PYRROLE-2-CARBOXYLATE, also known as ethyl 4-acetyl-1-pyrroline-2-carboxylate, is a synthetic organic compound that belongs to the class of pyrrole derivatives. It is a yellowish liquid with a molecular formula of C10H11NO3 and a molecular weight of 193.2 g/mol. This chemical is commonly used as a building block in organic synthesis and can be found in the production of pharmaceuticals and agrochemicals. It has a distinct odor and is soluble in organic solvents. Due to its potential hazards and risks, it is important to handle this chemical with caution and follow proper safety procedures.

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  • 119647-69-7 Structure
  • Basic information

    1. Product Name: ETHYL 4-ACETYL-1H-PYRROLE-2-CARBOXYLATE
    2. Synonyms: ETHYL 4-ACETYL-1H-PYRROLE-2-CARBOXYLATE;1H-Pyrrole-2-carboxylic acid, 4-acetyl-, ethyl ester
    3. CAS NO:119647-69-7
    4. Molecular Formula: C9H11NO3
    5. Molecular Weight: 181.19
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 119647-69-7.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.: N/A
    8. Solubility: N/A
    9. CAS DataBase Reference: ETHYL 4-ACETYL-1H-PYRROLE-2-CARBOXYLATE(CAS DataBase Reference)
    10. NIST Chemistry Reference: ETHYL 4-ACETYL-1H-PYRROLE-2-CARBOXYLATE(119647-69-7)
    11. EPA Substance Registry System: ETHYL 4-ACETYL-1H-PYRROLE-2-CARBOXYLATE(119647-69-7)
  • 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: 119647-69-7(Hazardous Substances Data)

119647-69-7 Usage

Uses

Used in Pharmaceutical Industry:
ETHYL 4-ACETYL-1H-PYRROLE-2-CARBOXYLATE is used as a building block in organic synthesis for the development of pharmaceuticals. Its unique chemical structure allows it to be incorporated into various drug molecules, contributing to the creation of new and effective medications.
Used in Agrochemical Industry:
ETHYL 4-ACETYL-1H-PYRROLE-2-CARBOXYLATE is used as a building block in organic synthesis for the production of agrochemicals. Its versatile chemical properties make it suitable for the development of various agrochemical products, such as pesticides and herbicides, to improve crop protection and yield.
Used in Organic Synthesis:
ETHYL 4-ACETYL-1H-PYRROLE-2-CARBOXYLATE is used as a key intermediate in the synthesis of various organic compounds. Its reactivity and functional groups enable chemists to create a wide range of molecules with diverse applications in different industries, including the development of new materials, dyes, and other specialty chemicals.

Check Digit Verification of cas no

The CAS Registry Mumber 119647-69-7 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,1,9,6,4 and 7 respectively; the second part has 2 digits, 6 and 9 respectively.
Calculate Digit Verification of CAS Registry Number 119647-69:
(8*1)+(7*1)+(6*9)+(5*6)+(4*4)+(3*7)+(2*6)+(1*9)=157
157 % 10 = 7
So 119647-69-7 is a valid CAS Registry Number.

119647-69-7SDS

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 4-acetyl-1H-pyrrole-2-carboxylate

1.2 Other means of identification

Product number -
Other names 4-ACETYL-1H-PYRROLE-2-CARBOXYLIC ACID ETHYL ESTER

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:119647-69-7 SDS

119647-69-7Relevant articles and documents

An efficient highly regioselective synthesis of 2,3,4-trisubstituted pyrroles by cycloaddition of polarized ketene S,S- and N,S-acetals with activated methylene isocyanides

Misra,Panda,Ila,Junjappa

, p. 1246 - 1251 (2007)

(Chemical Equation Presented) An efficient route for regioselective synthesis of 2,3,4- substituted pyrroles allowing precise control over the introduction of a number of substituents and functionalities (tosyl, carbalkoxy, aryl, cyano, nitro, acetyl, ben

PYRROLO[1,2-D][1,2,4]TRIAZINE-2-YL-ACETAMIDES AS INHIBITORS OF THE NLRP3 INFLAMMASOME PATHWAY

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Page/Page column 56, (2021/10/22)

The invention relates to novel compounds for use as inhibitors of NLRP3 inflammasone production, wherein such compounds are as defined by compounds of formula (I), Formula (I) and wherein the integers R1, R2 and R3 are defined in the description, and where the compounds may be useful as medicaments, for instance for use in the treatment of a disease or disorder that is associated with NLRP3 inflammasome activity.

The intramolecular photometathesis of pyrroles

Elliott, Luke D.,Berry, Malcolm,Orr-Ewing, Andrew J.,Booker-Milburn, Kevin I.

, p. 3078 - 3079 (2007/10/03)

UV irradiation of various electron deficient pyrrole derivatives induces a novel methathesis sequence resulting in selective cleavage of the 2,3-pyrrole bond. The overall sequence has been shown to proceed by two discrete wavelength-dependent steps involving sequential [2+2] cyclobutane formation followed by photochemically mediated retro-[2+2] to the products. Copyright

Cyclo[n]pyrroles and methods thereto

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Page 24, (2010/02/05)

The present invention provides an oxidative coupling procedure that allows efficient synthesis of novel cyclo[n]pyrrole macrocycles. Therefore, the present invention provides cyclo[n]pyrroles where n is 6, 7, 8, 9, 10, 11, or 12, and derivatives, multimers, isomers, and ion and neutral molecule complexes thereof as new compositions of matter. A protonated form of cyclo[n]pyrrole displays a gap of up to 700 nm between strong Soret and Q-like absorption bands in the electronic spectrum, demonstrating no significant ground state absorption in the visible portion of the electronic spectrum. Uses of cyclo[n]pyrroles as separation media, nonlinear optical materials, information storage media and infrared filters are provided.

Aromatic heterocycle compounds having HIV integrase inhibiting activities

-

, (2008/06/13)

A compound of the formula (I): wherein X is hydroxy, protected hydroxy or optionally substituted amino; Y is —COORAwherein RAis hydrogen or ester residue, —CONRBRCwherein RBand RCeach is independently hydrogen or amide residue, optionally substituted aryl or optionally substituted heteroaryl; and A1is optionally substituted heteroaryl; provided that a compound wherein Y and/or A1is optionally substituted indol-3-yl is excluded, a tautomer, a prodrug, a pharmaceutically acceptable salt or a hydrate thereof has an inhibitory activity against an integrase.

β-Acylation of ethyl pyrrole-2-carboxylate by Friedel-Crafts acylation: Scope and limitations (synthetic studies on indoles and related compounds. XXXVIII

Tani,Ariyasu,Nishiyama,Hagiwara,Watanabe,Yokoyama,Murakami

, p. 48 - 54 (2007/10/03)

The Friedel-Crafts acylation of ethyl pyrrole-2-carboxylate (3) was studied under several conditions using various Lewis acids and acyl chlorides. The acylation with various acyl chlorides in the presence of aluminum chloride gave exclusively ethyl 4-acylpyrrole-2-carboxylate (5), whereas weaker Lewis acids such as zinc chloride and boron trifluoride etherate gave a mixture of ethyl 4- and 5-acylpyrrole-2-carboxylates.

THE FRIEDEL-CRAFTS ACYLATION OF ETHYL PYRROLE-2-CARBOXYLATE. SCOPE, LIMITATIONS, AND APPLICATION TO SYNTHESIS OF 7-SUBSTITUTED INDOLES

Murakami, Yasuoki,Tani, Masanobu,Ariyasu, Takahiro,Nishiyama, Chika,Watanabe, Toshiko,Yokoyama, Yuusaku

, p. 1855 - 1860 (2007/10/02)

The Friedel-Crafts acylation of ethyl pyrrole-2-carboxylate (3) was studied under a variety of conditions using various Lewis acids and acyl chlorides.The acylation with some Lewis acids such as BF3*OEt2 gave a mixture of 4- and 5-acyl derivatives (5 and

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