Tris(4-trifluoromethylphenyl)phosphine

• CAS: 13406-29-6
• Catalog Number: ACM13406296
• Category: Other Products
• Molecular Weight: 466.286g/mol
• Molecular Formula: C21H12F9P
• Synonyms: J-006480; AX8155846; SCHEMBL287478; Tris[4-(trifluoromethyl)phenyl]phospine,; Tris(4-(trifluoromethyl)phenyl)phosphine; DB-009905; ACMC-20ajbq; C-22647; Tris(4-trifluoromethylphenyl)phosphine; CS-W011542
• IUPAC Name: tris[4-(trifluoromethyl)phenyl]phosphane
• Canonical SMILES: C1=CC(=CC=C1C(F)(F)F)P(C2=CC=C(C=C2)C(F)(F)F)C3=CC=C(C=C3)C(F)(F)F
• InChI: InChI=1S/C21H12F9P/c22-19(23,24)13-1-7-16(8-2-13)31(17-9-3-14(4-10-17)20(25,26)27)18-11-5-15(6-12-18)21(28,29)30/h1-12H
• InChI Key: PXYCJKZSCDFXLR-UHFFFAOYSA-N
• Complexity: 478
• Covalently-Bonded Unit Count: 1
• Exact Mass: 466.053g/mol
• H-Bond Acceptor: 9
• Heavy Atom Count: 31
• Monoisotopic Mass: 466.053g/mol
• Rotatable Bond Count: 3
• Topological Polar Surface Area: 0A^2

Synthetic Use

Upstream Synthesis Route 1

• 13406-27-4

• 13406-29-6

Reference: [1] Journal of Organic Chemistry, 2008, vol. 73, # 4, p. 1524 - 1531
[2] Russian Journal of General Chemistry, 2015, vol. 85, # 5, p. 1156 - 1160[3] Zh. Obshch. Khim.,
[4] Advanced Synthesis and Catalysis, 2016, vol. 358, # 1, p. 26 - 29

Upstream Synthesis Route 2

• 402-43-7

• 13406-29-6

Reference: [1] Advanced Synthesis and Catalysis, 2015, vol. 357, # 18, p. 4069 - 4081

Upstream Synthesis Route 3

• 402-43-7
• 7719-12-2

• 13406-29-6

Reference: [1] Patent: US5194652, 1993, A,

Upstream Synthesis Route 4

• 402-43-7

• 13406-29-6

Reference: [1]Advanced Synthesis and Catalysis,2015,vol. 357,p. 4069 - 4081

Upstream Synthesis Route 5

• 198345-82-3

• 13406-29-6

Reference: [1]Journal of Organic Chemistry,1991,vol. 56,p. 2762 - 2769