3-Bromothianaphthene

• CAS: 7342-82-7
• Catalog Number: ACM7342827
• Category: Bromine Series
• Molecular Weight: 213.1g/mol
• Molecular Formula: C8H5BrS
• IUPAC Name: 3-bromo-1-benzothiophene
• Canonical SMILES: C1=CC=C2C(=C1)C(=CS2)Br
• InChI: InChI=1S/C8H5BrS/c9-7-5-10-8-4-2-1-3-6(7)8/h1-5H
• InChI Key: SRWDQSRTOOMPMO-UHFFFAOYSA-N
• Complexity: 126
• Covalently-Bonded Unit Count: 1
• Exact Mass: 211.92953g/mol
• Formal Charge: 0
• H-Bond Acceptor: 1
• H-Bond Donor: 0
• Heavy Atom Count: 10
• Monoisotopic Mass: 211.92953g/mol
• Rotatable Bond Count: 0
• XLogP3: 3.8

Synthetic Use

Downstream Synthesis Route 1

• 7342-82-7
• 68-12-2

• 5381-20-4

Reference: [1] Journal of Organic Chemistry, 2008, vol. 73, # 22, p. 8705 - 8710
[2] Bioorganic and Medicinal Chemistry, 2007, vol. 15, # 17, p. 5981 - 5996
[3] Synlett, 2002, # 12, p. 2083 - 2085
[4] Bioorganic and Medicinal Chemistry, 2006, vol. 14, # 3, p. 714 - 723
[5] Patent: CN108250058, 2018, A, . Location in patent: Paragraph 0381; 0387-0389

Downstream Synthesis Route 2

• 7342-82-7
• 201230-82-2

• 5381-20-4

Reference: [1] Chemistry - An Asian Journal, 2012, vol. 7, # 10, p. 2213 - 2216
[2] Angewandte Chemie - International Edition, 2006, vol. 45, # 1, p. 154 - 158

Downstream Synthesis Route 3

• 7342-82-7

• 5381-20-4

Reference: [1] Patent: US4659717, 1987, A,

Downstream Synthesis Route 4

• 7342-82-7

• 5381-25-9

Reference: [1]Journal fur praktische Chemie (Leipzig 1954),1933,vol. <2> 138,p. 109,116
[2]Synlett,2002,p. 2083 - 2085

Downstream Synthesis Route 5

• 7342-82-7

• 17402-78-7

Reference: [1]Current Patent Assignee: LT SAMBO CO LTD - KR2016/51212, 2016, A
Location in patent: Paragraph 0141-0143

Downstream Synthesis Route 6

• 67-56-1
• 7342-82-7
• 201230-82-2

• 5381-25-9
• 22913-25-3

Reference: [1]Journal of Organic Chemistry,1995,vol. 60,p. 8336 - 8340

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