4-chlorobenzothiophene-2-carboxylate

• CAS: 23967-57-9
• Catalog Number: ACM23967579
• Category: Other Products
• Molecular Weight: 212.6528
• Molecular Formula: C9H5ClO2S
• Synonyms: ZINC04200409, CID7127695, 23967-57-9
• IUPAC Name: 4-chloro-1-benzothiophene-2-carboxylate
• Canonical SMILES: C1=CC2=C(C=C(S2)C(=O)O)C(=C1)Cl
• InChI Key: IPAXPERGAMNMIJ-UHFFFAOYSA-M
• Boiling Point: 408.6ºC at 760mmHg
• Melting Point: 220-223ºC
• Flash Point: 200.9ºC
• Density: 1.546g/cm³
• Exact Mass: 211.97000
• Hazard Statements: Xi
• H-Bond Acceptor: 2
• H-Bond Donor: 0

Synthetic Use

Upstream Synthesis Route 1

• 35212-95-4

• 23967-57-9

Reference: [1] Patent: WO2012/155352, 2012, A1, . Location in patent: Page/Page column 50

Upstream Synthesis Route 2

• 1420987-79-6

• 23967-57-9

Reference: [1] Patent: WO2013/15456, 2013, A1, . Location in patent: Page/Page column 40

Upstream Synthesis Route 3

• 35212-95-4

• 23967-57-9

Reference: [1]Patent: WO2012/155352,2012,A1 .Location in patent: Page/Page column 50

Downstream Synthesis Route 1

• 23967-57-9

• 66490-33-3

Reference: [1] Tetrahedron Letters, 2004, vol. 45, # 52, p. 9645 - 9647
[2] Patent: WO2013/15456, 2013, A1, . Location in patent: Page/Page column 41; 42

Downstream Synthesis Route 2

• 23967-57-9

• 66490-33-3

Reference: [1]Tetrahedron Letters,2004,vol. 45,p. 9645 - 9647
[2]Patent: WO2013/15456,2013,A1 .Location in patent: Page/Page column 41; 42

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