Dimethyl 2,3-dibromosuccinate

Base Information

• Chemical Name: Dimethyl 2,3-dibromosuccinate
• CAS No.: 51575-86-1
• Molecular Formula: C6H8Br2O4
• Molecular Weight: 303.935
• DSSTox Substance ID: DTXSID10965898
• Nikkaji Number: J90.554B
• ChEMBL ID: CHEMBL3248467
• Mol file: 51575-86-1.mol

Synonyms:Dimethyl 2,3-dibromosuccinate;1186-98-7;Dimethyl 2,3-Dibromo-1,4-butanedioate;dimethyl 2,3-dibromobutanedioate;51575-86-1;TL 127;Succinic acid, alpha,alpha'-dibromo-, dimethyl ester;Butanedicarbonic acid,-2,3-dibromo, dimethyl ester;dimethyl 2,3-dibromobutane-1,4-dioate;SCHEMBL1415223;C6-H6-Br2-O4;CHEMBL3248467;Dimethyl 2,3-dibromosuccinate #;DTXSID10965898;MFCD00077961;TL-127;AKOS003614461;LS-147415;CS-0364927;FT-0625055;Butanedioic acid, 2,3-dibromo-, dimethyl ester;Dimethyl 2,3-Dibromo-1,4-butanedioate, (2R,3R)-rel-;Butanedioic acid, 2,3-dibromo-, 1,4-dimethyl ester, (2R,3R)-rel-

Chemical Property of Dimethyl 2,3-dibromosuccinate

Chemical Property:

• Melting Point: 41-42 °C
• Boiling Point: 256.0±35.0 °C(Predicted)
• PSA: 52.60000
• Density: 1.880±0.06 g/cm3(Predicted)
• LogP: 0.85940
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 303.87688
• Heavy Atom Count: 12
• Complexity: 162

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(C(=O)OC)Br)Br

Technology Process of Dimethyl 2,3-dibromosuccinate

There total 3 articles about Dimethyl 2,3-dibromosuccinate 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: 98.0%

methanol (67-56-1) + 2,3-dibromosuccinic acid (526-78-3,608-35-5,608-36-6,1114-00-7) → dimethyl 2,3-dibromobutane-1,4-dicarboxylate (51575-86-1)

Guidance literature:

With thionyl chloride; at 20 ℃; for 2h;

Reference yield:

methanol (67-56-1) → dibromo-2,3 succinate de methyle threo racemique (1186-98-7,17582-64-8,51575-86-1)

Guidance literature:

With hydrogenchloride;

Reference yield:

→ dimethyl meso-2,3-dibromosuccinate (1186-98-7,17582-64-8,51575-86-1)

Guidance literature:

Dimethylmaleat, Br2 (S. 3);

DOI:10.1016/S0022-1139(00)83110-3

upstream raw materials:

methanol

2,3-dibromosuccinic acid

Downstream raw materials:

dimethylfumarate

methyl 3-hydroxy-5-isoxazolecarboxylate

trans-2-bromobutenedioic acid dimethyl ester

tetraethylammonium bromide