5-(3-bromo-4-hydroxy-5-iodobenzylidene)-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione

Base Information

Chemical Name:5-(3-bromo-4-hydroxy-5-iodobenzylidene)-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione
CAS No.:6012-49-3
Molecular Formula:C9H6 Cl2 N4 O
Molecular Weight:257.079
Hs Code.:
DSSTox Substance ID:DTXSID10417322

Synonyms:STK170871;5-(3-bromo-4-hydroxy-5-iodobenzylidene)-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione;6012-49-3;CBMicro_049781;DTXSID10417322;AKOS000323537;BIM-0049778.P001

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Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 5-(3-bromo-4-hydroxy-5-iodobenzylidene)-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione

Chemical Property:

Vapor Pressure:1.06E-08mmHg at 25°C
Boiling Point:449.6°C at 760 mmHg
Flash Point:225.7°C
Density:2.089g/cm³
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:463.88687
Heavy Atom Count:21
Complexity:498

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN1C(=O)C(=CC2=CC(=C(C(=C2)I)O)Br)C(=O)N(C1=O)C

Technology Process of 5-(3-bromo-4-hydroxy-5-iodobenzylidene)-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione

There total 2 articles about 5-(3-bromo-4-hydroxy-5-iodobenzylidene)-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione 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:

Reference yield: 90.0%

: 108-77-0
1,3,5-trichloro-2,4,6-triazine

: 591-27-5
m-Hydroxyaniline

: 6012-49-3
3-(4,6-dichloro-[1,3,5]triazin-2-ylamino)-phenol

Guidance literature:: 1,3,5-trichloro-2,4,6-triazine; m-Hydroxyaniline; In acetone; at 0 ℃; for 0.333333h;

With sodium hydrogencarbonate; In water; acetone; at 0 ℃; for 1.33333h; pH=6 - 7;
DOI:10.1021/jacs.1c01626