Methyl 4,5-dibromo-2-furoate

• CAS: 54113-41-6
• Catalog Number: ACM54113416
• Category: Other Products
• Molecular Weight: 283.902160 [g/mol]
• Molecular Formula: C6H4Br2O3
• Synonyms: Methyl 4,5-dibromo-2-furoate, Methyl 4,5-dibromofuran-2-carboxylate, 54113-41-6, AC1N4V8D, SureCN1198786, AC1Q42Z7, CTK4J9655, MolPort-001-814-144, ANW-57146, AKOS016002670, AK-67852, KB-54255, QC-10359
• IUPAC Name: methyl 4,5-dibromofuran-2-carboxylate
• Canonical SMILES: COC(=O)C1=CC(=C(O1)Br)Br
• InChI Key: OIOPUTCGINQNRL-UHFFFAOYSA-N
• Boiling Point: 278.7ºC at 760 mmHg
• Flash Point: 122.4ºC
• Density: 1.992g/cm³
• Exact Mass: 281.85300
• H-Bond Acceptor: 3
• H-Bond Donor: 0

Synthetic Use

Downstream Synthesis Route 1

• 54113-41-6

• 611-13-2
• 58235-80-6

Reference: [1] Chemistry of Heterocyclic Compounds (New York, NY, United States), 1982, vol. 18, # 2, p. 134 - 138[2] Khimiya Geterotsiklicheskikh Soedinenii, 1982, vol. 18, # 2, p. 176 - 180

Downstream Synthesis Route 2

• 54113-41-6

• 2434-03-9

Reference: [1] Patent: WO2008/124518, 2008, A1, . Location in patent: Page/Page column 18

Downstream Synthesis Route 3

• 54113-41-6

• 58235-80-6

Reference: [1] European Journal of Medicinal Chemistry, 2016, vol. 117, p. 47 - 58
[2] Journal of Agricultural and Food Chemistry, 2017, vol. 65, # 26, p. 5397 - 5403
[3] Bioorganic and Medicinal Chemistry, 2012, vol. 20, # 6, p. 2019 - 2024
[4] Patent: CN105503832, 2016, A, . Location in patent: Paragraph 0065; 0066; 0069; 0070
[5] Patent: WO2008/98104, 2008, A1, . Location in patent: Page/Page column 217

Downstream Synthesis Route 4

• 54113-41-6

• 611-13-2
• 58235-80-6

Reference: [1]Chemistry of Heterocyclic Compounds,1982,vol. 18,p. 134 - 138
Khimiya Geterotsiklicheskikh Soedinenii,1982,vol. 18,p. 176 - 180

Downstream Synthesis Route 5

• 54113-41-6

• 2434-03-9

Reference: [1]Patent: WO2008/124518,2008,A1 .Location in patent: Page/Page column 18

Downstream Synthesis Route 6

• 54113-41-6
• 5158-46-3

• 2528-02-1

Reference: [1]Bach; Krüger
[Synlett, 1998, # 11, p. 1185 - 1186]
[2]Bach, Thorsten; Krüger, Lars
[European Journal of Organic Chemistry, 1999, # 9, p. 2045 - 2057]
[3]Current Patent Assignee: SYNTA PHARMACEUTICALS CORP. - WO2009/17818, 2009, A1
Location in patent: Page/Page column 49-50
[4]Current Patent Assignee: SYNTA PHARMACEUTICALS CORP. - WO2007/87429, 2007, A2
Location in patent: Page/Page column 115

* For details of the synthesis route, please refer to the original source to ensure accuracy.