2-[(Trifluoromethyl)sulfinyl]-1,1'-biphenyl

• CAS: 129922-49-2
• Catalog Number: ACM129922492
• Category: Other Products
• Molecular Weight: 270.27g/mol
• Molecular Formula: C13H9F3OS
• IUPAC Name: 1-phenyl-2-(trifluoromethylsulfinyl)benzene
• Canonical SMILES: C1=CC=C(C=C1)C2=CC=CC=C2S(=O)C(F)(F)F
• InChI: InChI=1S/C13H9F3OS/c14-13(15,16)18(17)12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9H
• InChI Key: CLDLXLKMMYJIEK-UHFFFAOYSA-N
• Complexity: 297
• Covalently-Bonded Unit Count: 1
• Exact Mass: 270.032621g/mol
• Formal Charge: 0
• H-Bond Acceptor: 5
• H-Bond Donor: 0
• Heavy Atom Count: 18
• Monoisotopic Mass: 270.032621g/mol
• Rotatable Bond Count: 2
• XLogP3: 3.8

Synthetic Use

Downstream Synthesis Route 1

• 358-23-6
• 129922-49-2

• 129946-88-9

Reference: [1] Tetrahedron Letters, 1990, vol. 31, # 25, p. 3579 - 3582
[2] Journal of the American Chemical Society, 1993, vol. 115, # 6, p. 2156 - 2164

Downstream Synthesis Route 2

• 129922-49-2

• 129946-88-9

Reference: [1] Journal of Fluorine Chemistry, 1999, vol. 98, # 1, p. 75 - 81
[2] Journal of Fluorine Chemistry, 1998, vol. 92, # 2, p. 181 - 187

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