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2-amino-7-(2,3-dihydroxypropyl)-6-(methylsulfanyl)-4-oxo-4,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile is a chemical with a specific purpose. Lookchem provides you with multiple data and supplier information of this chemical.

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  • 3H-Pyrrolo[2,3-d]pyrimidine-5-carbonitrile,2-amino-7-(2,3-dihydroxypropyl)-4,7-dihydro-6-(methylthio)-4-oxo-

    Cas No: 127945-69-1

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  • 127945-69-1 Structure
  • Basic information

    1. Product Name: 2-amino-7-(2,3-dihydroxypropyl)-6-(methylsulfanyl)-4-oxo-4,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile
    2. Synonyms: 2-Amino-5-cyano-6-(methylthio)-7-((RS)-2,3-dihydroxypropyl)pyrrolo(2,3-d)-pyrimidin-4-one; 2-Amino-5-cyano-6-(methylthio)-7-[(RS)-2,3-dihydroxypropyl]pyrrolo[2,3-d]-pyrimidin-4-one; 2-amino-7-(2,3-dihydroxypropyl)-4-hydroxy-6-(methylsulfanyl)-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile; 7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile, 2-amino-7-(2,3-dihydroxypropyl)-4-hydroxy-6-(methylthio)-
    3. CAS NO:127945-69-1
    4. Molecular Formula: C11H13N5O3S
    5. Molecular Weight: 295.3176
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 127945-69-1.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 484.7°C at 760 mmHg
    3. Flash Point: 247°C
    4. Appearance: N/A
    5. Density: 1.71g/cm3
    6. Vapor Pressure: 3.3E-10mmHg at 25°C
    7. Refractive Index: 1.78
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. CAS DataBase Reference: 2-amino-7-(2,3-dihydroxypropyl)-6-(methylsulfanyl)-4-oxo-4,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile(CAS DataBase Reference)
    11. NIST Chemistry Reference: 2-amino-7-(2,3-dihydroxypropyl)-6-(methylsulfanyl)-4-oxo-4,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile(127945-69-1)
    12. EPA Substance Registry System: 2-amino-7-(2,3-dihydroxypropyl)-6-(methylsulfanyl)-4-oxo-4,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile(127945-69-1)
  • 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: 127945-69-1(Hazardous Substances Data)

127945-69-1 Usage

Core Structure

Pyrrolopyrimidine

Functional Groups

Amino group (NH2)
Carbonitrile group (CN)
Hydroxyl group (-OH)
Methylsulfanyl group (-SCH3)

Properties

Complex organic molecule
Contains heterocyclic rings (pyrrolopyrimidine)
Presence of both electron-donating (hydroxyl, amino) and electron-withdrawing (carbonitrile) groups

Potential Applications

Pharmaceutical applications due to unique structure
Potential interaction with biological targets

Research and Testing

Further research and testing required to understand properties and potential uses

Check Digit Verification of cas no

The CAS Registry Mumber 127945-69-1 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,2,7,9,4 and 5 respectively; the second part has 2 digits, 6 and 9 respectively.
Calculate Digit Verification of CAS Registry Number 127945-69:
(8*1)+(7*2)+(6*7)+(5*9)+(4*4)+(3*5)+(2*6)+(1*9)=161
161 % 10 = 1
So 127945-69-1 is a valid CAS Registry Number.

127945-69-1SDS

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 2-amino-7-(2,3-dihydroxypropyl)-6-methylsulfanyl-4-oxo-1H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile

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:127945-69-1 SDS

127945-69-1Downstream Products

127945-69-1Relevant articles and documents

Synthesis and Antivirial Activity of Some Acyclic and C-Acyclic Pyrrolopyrimidine Nucleoside Analogues

Bennett, Sharon M.,Nguyen-Ba, Nghe,Ogilvie, Kelvin K.

, p. 2162 - 2173 (2007/10/02)

A series of acyclic and C-acyclic 7-deazapurine nucleosides have been synthesized and tested for antivirial activity.Reaction of the sodium salt of 2-amino-3,4-bis(aminocarbonyl)-5-(methylthio)pyrrole (6) with an appropriate electrophile gave pyrrole nucl

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