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Deazaflavin

Base Information
  • Chemical Name:Deazaflavin
  • CAS No.:26908-38-3
  • Molecular Formula:C11H7 N3 O2
  • Molecular Weight:213.195
  • Hs Code.:
  • NSC Number:106042
  • UNII:K2CC2RHC84
  • DSSTox Substance ID:DTXSID10181415
  • Nikkaji Number:J468.277G
  • Wikidata:Q27106341
  • ChEMBL ID:CHEMBL1905125
  • Mol file:26908-38-3.mol
Deazaflavin

Synonyms:5-deazaflavin

Suppliers and Price of Deazaflavin
Supply Marketing:
Business phase:
The product has achieved commercial mass production*data from LookChem market partment
Manufacturers and distributors:
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Total 55 raw suppliers
Chemical Property of Deazaflavin
Chemical Property:
  • Boiling Point:°Cat760mmHg 
  • Flash Point:°C 
  • PSA:78.61000 
  • Density:1.434g/cm3 
  • LogP:0.76460 
  • XLogP3:1
  • Hydrogen Bond Donor Count:2
  • Hydrogen Bond Acceptor Count:3
  • Rotatable Bond Count:0
  • Exact Mass:213.053826475
  • Heavy Atom Count:16
  • Complexity:331
Purity/Quality:

99%HPLC *data from raw suppliers

Safty Information:
  • Pictogram(s):  
  • Hazard Codes: 
MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:C1=CC=C2C(=C1)C=C3C(=N2)NC(=O)NC3=O
Technology Process of Deazaflavin

There total 1 articles about Deazaflavin which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:
Guidance literature:
With sodium hydride; In N,N-dimethyl-formamide; for 2h; Ambient temperature;
Refernces

Asymmetric reduction with 5-deazaflavin. II. Synthesis of some chiral 5-deazaflavin derivatives

10.1248/cpb.38.312

The research focuses on the development of functional biomimetic coenzyme models, specifically the synthesis of chiral 5-deazaflavin derivatives. The purpose of this study was to prepare new types of chiral deazaflavin derivatives that could effectively discriminate the enantiotopic faces of carbonyls in asymmetric reduction reactions, potentially serving as models for enzymatic systems. The researchers synthesized 5-deazaflavin derivatives with chiral substituents at the C(6) position and a chiral tertiary asymmetric carbon center at C(5). They used various chemicals in the process, including 8-chloro derivative, chiral primary amines such as (+)-dehydroabietylamine and (S)-(-)-phenylethylamine, dicyclohexylcarbodimide (DCC), and N-(tert-butoxycarbonyl)-L-valine.

Addition of nucleophiles to 5-deazaflavins, part 2

10.1002/ardp.19903230203

The research investigates the addition of nucleophiles to 5-deazaflavins and 5-dedavinium salts, revealing a nicotinamide analogy in the addition of water, alcohols, metalorganic compounds, and amines at the 5-position of the 5-deazatavin structure. The study explores reactions with water and alcohols, finding that nucleophilic attack occurs at the 5-position, leading to the formation of various products, including ring-opening reactions in alkaline solutions. The research also examines the behavior of 5-deazaflavinium salts, which show different reactivity patterns compared to 5-deazaflavins, such as the formation of stable 5-adducts under certain conditions. Additionally, the study explores the reactions with metalorganic compounds, demonstrating the potential for synthesizing new C-substituted reduced 5-deazaflavins. The chemicals involved in the research include 5-deazaflavins, 5-dedavinium salts, various alcohols, metalorganic compounds like Grignard reagents, and amines. The study also involves the synthesis of several adducts and intermediates, such as 5-ethoxy, 5-ethyl, 5-benzyl, and other substituted 5-deazaflavin derivatives, which are characterized using spectroscopic methods.

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