6-Benzothiazolecarboxylicacid,2-bromo-

• CAS: 22514-58-5
• Catalog Number: ACM22514585
• Category: Other Products
• Molecular Weight: 258.09186
• Molecular Formula: C₈H₄BrNO₂S
• Synonyms: 2-BROMO-6-BENZOTHIAZOLECARBOXYLIC ACID;2-bromobenzo[d]thiazole-6-carboxylic acid
• IUPAC Name: 2-bromo-1,3-benzothiazole-6-carboxylic acid
• Canonical SMILES: C1=CC2=C(C=C1C(=O)O)SC(=N2)Br
• InChI Key: ICKXPLAJDFRFME-UHFFFAOYSA-N
• Boiling Point: 444.1ºC at 760 mmHg
• Flash Point: 222.4ºC
• Density: 1.912g/cm³
• Exact Mass: 256.91500
• H-Bond Acceptor: 4
• H-Bond Donor: 1

Synthetic Use

Upstream Synthesis Route 1

• 66947-92-0

• 22514-58-5

Reference: [1] Patent: WO2008/124393, 2008, A1, . Location in patent: Page/Page column 33-34

Upstream Synthesis Route 2

• 1024583-33-2

• 22514-58-5

Reference: [1] Bioorganic and Medicinal Chemistry Letters, 2008, vol. 18, # 7, p. 2324 - 2328

Downstream Synthesis Route 1

• 22514-58-5
• 18107-18-1

• 1024583-33-2

Reference: [1] Patent: US2011/152287, 2011, A1, . Location in patent: Page/Page column 21

Downstream Synthesis Route 2

• 22514-58-5
• 75-65-0

• 945400-88-4

Reference: [1]Patent: WO2007/86800,2007,A1 .Location in patent: Page/Page column 100

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