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6-chloro-1H-pyrrolo[2,3-b]pyridin-2(3H)-one is a heterocyclic chemical compound characterized by a molecular formula of C7H4ClN2O. It features a pyrrolopyridinone core with a chlorine substituent, which contributes to its unique structure and properties. 6-chloro-1H-pyrrolo[2,3-b]pyridin-2(3H)-one has garnered interest in the fields of medicinal chemistry and drug development due to its potential pharmacological activities and its utility in designing new compounds with biological activity.

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  • 220896-14-0 Structure
  • Basic information

    1. Product Name: 6-chloro-1H-pyrrolo[2,3-b]pyridin-2(3H)-one
    2. Synonyms: 6-chloro-1H-pyrrolo[2,3-b]pyridin-2(3H)-one;6-Chloro-7-aza-2-oxindole;6-chloro-1H,2H,3H-pyrrolo[2,3-b]pyridin-2-one;2H-Pyrrolo[2,3-b]pyridin-2-one,6-chloro-1,3-dihydro-
    3. CAS NO:220896-14-0
    4. Molecular Formula: C7H5ClN2O
    5. Molecular Weight: 168.58
    6. EINECS: N/A
    7. Product Categories: CHIRAL CHEMICALS
    8. Mol File: 220896-14-0.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 376.001°C at 760 mmHg
    3. Flash Point: 181.199°C
    4. Appearance: /
    5. Density: 1.45g/cm3
    6. Vapor Pressure: 0mmHg at 25°C
    7. Refractive Index: 1.61
    8. Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
    9. Solubility: N/A
    10. PKA: 2.49±0.40(Predicted)
    11. CAS DataBase Reference: 6-chloro-1H-pyrrolo[2,3-b]pyridin-2(3H)-one(CAS DataBase Reference)
    12. NIST Chemistry Reference: 6-chloro-1H-pyrrolo[2,3-b]pyridin-2(3H)-one(220896-14-0)
    13. EPA Substance Registry System: 6-chloro-1H-pyrrolo[2,3-b]pyridin-2(3H)-one(220896-14-0)
  • 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: 220896-14-0(Hazardous Substances Data)

220896-14-0 Usage

Uses

Used in Medicinal Chemistry:
6-chloro-1H-pyrrolo[2,3-b]pyridin-2(3H)-one is utilized as a key intermediate in the synthesis of various pharmaceutical compounds. Its unique structure allows for the development of new molecules with enhanced biological activity, making it a valuable component in the creation of novel therapeutic agents.
Used in Drug Development:
In the pharmaceutical industry, 6-chloro-1H-pyrrolo[2,3-b]pyridin-2(3H)-one is employed as a potential antitumor agent. Its pharmacological properties have been studied for their ability to target and inhibit the growth of cancer cells, offering a promising avenue for the development of new cancer treatments.
Used in Organic Chemistry Research:
6-chloro-1H-pyrrolo[2,3-b]pyridin-2(3H)-one serves as a subject of research in organic chemistry, where its synthesis and characterization are explored to understand its reactivity and potential applications in the formation of complex organic molecules.
Used in Medicinal Chemistry Research:
6-chloro-1H-pyrrolo[2,3-b]pyridin-2(3H)-one is also used in medicinal chemistry research to investigate its potential as a lead compound for the development of new drugs. Its structure and properties are analyzed to identify ways to optimize its pharmacological activity and selectivity, with the goal of improving its therapeutic potential.

Check Digit Verification of cas no

The CAS Registry Mumber 220896-14-0 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 2,2,0,8,9 and 6 respectively; the second part has 2 digits, 1 and 4 respectively.
Calculate Digit Verification of CAS Registry Number 220896-14:
(8*2)+(7*2)+(6*0)+(5*8)+(4*9)+(3*6)+(2*1)+(1*4)=130
130 % 10 = 0
So 220896-14-0 is a valid CAS Registry Number.
InChI:InChI=1/C7H5ClN2O/c8-5-2-1-4-3-6(11)10-7(4)9-5/h1-2H,3H2,(H,9,10,11)

220896-14-0SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 18, 2017

Revision Date: Aug 18, 2017

1.Identification

1.1 GHS Product identifier

Product name 6-chloro-1,3-dihydropyrrolo[2,3-b]pyridin-2-one

1.2 Other means of identification

Product number -
Other names 6-Chloro-7-aza-2-oxindole

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:220896-14-0 SDS

220896-14-0Relevant articles and documents

Indolin-2-one p38α inhibitors II: Lead optimisation

Eastwood, Paul,González, Jacob,Gómez, Elena,Caturla, Francisco,Balagué, Cristina,Orellana, Adelina,Domínguez, María

, p. 5270 - 5273 (2011/10/09)

Optimisation of a series of indolin-2-one p38α inhibitors was achieved via both blocking of a potential metabolic 'hot spot' and by increasing overall polarity of the lead series leading to non-cytotoxic compounds which showed improved oral bioavailabilities in the rat.

Substituted aza-oxindole derivatives

-

, (2008/06/13)

Substituted aza-oxindole derivatives useful as cyclin dependent kinase 11 inhibitors, for preventing/reducing the severity of epithelial cytotoxicity side-effects (e.g., alopecia, plantar-palmar syndrome, mucositis) induced by chemoptherapy and/or radiati

3-(anilinomethylene) oxindoles

-

Page column 70-71, (2010/02/04)

The present invention relates generally to novel amine substituted oxindole compounds and compositions. Such compounds and compositions have utility as pharmacological agents in treating diseases or conditions alleviated by the inhibition or antagonism of

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