I+/-,I(2)-DibromzimtsA currencyuremethylester

Base Information

• Chemical Name: I+/-,I(2)-DibromzimtsA currencyuremethylester
• CAS No.: 63189-41-3
• Molecular Formula: C10H8 Br2 O2
• Molecular Weight: 319.9773
• NSC Number: 59886
• DSSTox Substance ID: DTXSID60418127
• Wikidata: Q82228446
• Mol file: 63189-41-3.mol

Synonyms:NSC59886;63189-41-3;DTXSID60418127;NSC-59886;I+/-,I(2)-DibromzimtsA currencyuremethylester

Chemical Property of I+/-,I(2)-DibromzimtsA currencyuremethylester

Chemical Property:

• Vapor Pressure: 0.000238mmHg at 25°C
• Boiling Point: 324.9°C at 760 mmHg
• Flash Point: 150.3°C
• Density: 1.778g/cm³
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 319.88706
• Heavy Atom Count: 14
• Complexity: 243

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)C(=C(C1=CC=CC=C1)Br)Br
• Isomeric SMILES: COC(=O)/C(=C(/C1=CC=CC=C1)\Br)/Br

Technology Process of I+/-,I(2)-DibromzimtsA currencyuremethylester

There total 4 articles about I+/-,I(2)-DibromzimtsA currencyuremethylester 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:

diazomethane (186581-53-3,908094-01-9,334-88-3) + α,β-dibromo-cis-cinnamic acid (708-82-7) → Methyl-cis-α,β-dibromocinnamat (63189-41-3)

Guidance literature:

With diethyl ether;

DOI:10.1039/jr9360000402

Reference yield:

diazomethane (186581-53-3,908094-01-9,334-88-3) + (E)-2,3-Dibromo-3-phenyl-acrylic acid (708-81-6) → Methyl-trans-α,β-dibromocinnamat (63189-41-3)

Guidance literature:

With diethyl ether;

DOI:10.1039/jr9360000402

Reference yield:

methyl iodide (74-88-4) → Methyl-cis-α,β-dibromocinnamat (63189-41-3)

Guidance literature:

upstream raw materials:

diazomethane

α,β-dibromo-cis-cinnamic acid

methyl iodide

(E)-2,3-Dibromo-3-phenyl-acrylic acid