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112089-13-1

"9-(3-bromobenzyl)-N,N-dimethyl-9H-purin-6-amine" is a complex organic compound with the molecular formula C14H14BrN5. It is a derivative of purine, a heterocyclic aromatic organic compound that is a central component of nucleic acids, such as DNA and RNA. This specific compound features a 3-bromobenzyl group attached to the 9-position of the purine ring, and two methyl groups (N,N-dimethyl) attached to the 6-amine position. The presence of the bromine atom in the benzyl group provides a reactive site for further chemical modifications, making this compound potentially useful in the synthesis of various pharmaceuticals and biologically active molecules. Its structure and properties make it a candidate for research in medicinal chemistry, particularly in the development of drugs targeting purine-related metabolic pathways or as a building block for more complex molecules.

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  • 112089-13-1 Structure

  • Basic information

    1. Product Name: 9-(3-bromobenzyl)-N,N-dimethyl-9H-purin-6-amine
    2. Synonyms: 9H-Purin-6-amine, 9-((3-bromophenyl)methyl)-N,N-dimethyl-
    3. CAS NO:112089-13-1
    4. Molecular Formula: C14H14BrN5
    5. Molecular Weight: 332.1985
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 112089-13-1.mol

  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 504.5°C at 760 mmHg
    3. Flash Point: 258.9°C
    4. Appearance: N/A
    5. Density: 1.51g/cm3
    6. Vapor Pressure: 2.64E-10mmHg at 25°C
    7. Refractive Index: 1.689
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. CAS DataBase Reference: 9-(3-bromobenzyl)-N,N-dimethyl-9H-purin-6-amine(CAS DataBase Reference)
    11. NIST Chemistry Reference: 9-(3-bromobenzyl)-N,N-dimethyl-9H-purin-6-amine(112089-13-1)
    12. EPA Substance Registry System: 9-(3-bromobenzyl)-N,N-dimethyl-9H-purin-6-amine(112089-13-1)

  • 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: 112089-13-1(Hazardous Substances Data)

112089-13-1 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 112089-13-1 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,1,2,0,8 and 9 respectively; the second part has 2 digits, 1 and 3 respectively.
Calculate Digit Verification of CAS Registry Number 112089-13:
(8*1)+(7*1)+(6*2)+(5*0)+(4*8)+(3*9)+(2*1)+(1*3)=91
91 % 10 = 1
So 112089-13-1 is a valid CAS Registry Number.

112089-13-1SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 19, 2017

Revision Date: Aug 19, 2017

1.Identification

1.1 GHS Product identifier

Product name 9-[(3-bromophenyl)methyl]-N,N-dimethylpurin-6-amine

1.2 Other means of identification

Product number -
Other names 9H-Purin-6-amine,9-((3-bromophenyl)methyl)-N,N-dimethyl

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:112089-13-1 SDS

112089-13-1Downstream Products

112089-13-1Relevant articles and documents

6-(Alkylamino)-9-benzyl-9H-purines. A New Class of Anticonvulsant Agents

Kelley, James L.,Krochmal, Mark P.,Linn, James A.,McLean, Ed W.,Soroko, Francis E.

, p. 606 - 612 (2007/10/02)

Several 9-alkyl-6-substituted-purines were synthesized and tested for anticonvulsant activity against maximal electroshock-induced seizures (MES) in rats.Most compounds were prepared in three steps from 5-amino-4,6-dichloropyrimidine or in two steps via alkylation of 6-chloropurine.Potent anticonvulsant activity against MES resided in compounds that contain a benzyl substituent at the 9-position of 6-(methylamino)- or 6-(dimethylamino)purine.Among commonly used agents for control of seizures, this type of structure represents a new class of potent anticonvulsant agents.

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