(3-Methoxy-2-trimethylsilyl-phenyl)trifluoromethanesulfonate

• CAS: 217813-03-1
• Catalog Number: ACM217813031
• Category: Alkyl Silane
• Molecular Weight: 312.38
• Molecular Formula: C₁₁H₁₅F₃O₃SSi
• Synonyms: 2-trimethylsilyl-3-methoxyphenyl triflate; 3-Methoxy-2-(trimethylsilyl)phenyl Triflate; 3-Methoxy-2-(triMethylsilyl)phenyl TrifluoroMethanesulfonate; M1884; Trifluoromethanesulfonic Acid 3-Methoxy-2-(trimethylsilyl)phenyl Ester; 3-methoxy-2-trimethylsilylphenyl trifluoromethanesulfonate; 3-methoxy-2-trimethylsilylphenyl triflate
• IUPAC Name: (3-methoxy-2-trimethylsilylphenyl)trifluoromethanesulfonate
• Canonical SMILES: COC1=C(C(=CC=C1)OS(=O)(=O)C(F)(F)F)[Si](C)(C)C
• InChI Key: OJVREKSBMMQLBJ-UHFFFAOYSA-N
• Boiling Point: 337.5ºC at 760 mmHg
• Flash Point: 157.9ºC
• Density: 1.25
• Appearance: Transparent liquid
• Exact Mass: 328.04100

Custom Q&A

What is the molecular formula of (3-Methoxy-2-trimethylsilyl-phenyl)trifluoromethanesulfonate?

The molecular formula is C11H15F3O4SSi.

What is the molecular weight of (3-Methoxy-2-trimethylsilyl-phenyl)trifluoromethanesulfonate?

The molecular weight is 328.38 g/mol.

What is the IUPAC name of (3-Methoxy-2-trimethylsilyl-phenyl)trifluoromethanesulfonate?

The IUPAC name is (3-methoxy-2-trimethylsilylphenyl) trifluoromethanesulfonate.

What is the InChI of (3-Methoxy-2-trimethylsilyl-phenyl)trifluoromethanesulfonate?

The InChI is InChI=1S/C11H15F3O4SSi/c1-17-8-6-5-7-9(10(8)20(2,3)4)18-19(15,16)11(12,13)14/h5-7H,1-4H3.

What is the InChIKey of (3-Methoxy-2-trimethylsilyl-phenyl)trifluoromethanesulfonate?

The InChIKey is OJVREKSBMMQLBJ-UHFFFAOYSA-N.

What is the canonical SMILES of (3-Methoxy-2-trimethylsilyl-phenyl)trifluoromethanesulfonate?

The canonical SMILES is COC1=C(C(=CC=C1)OS(=O)(=O)C(F)(F)F)[Si](C)(C)C.

What is the CAS number of (3-Methoxy-2-trimethylsilyl-phenyl)trifluoromethanesulfonate?

The CAS number is 217813-03-1.

What is the European Community (EC) number of (3-Methoxy-2-trimethylsilyl-phenyl)trifluoromethanesulfonate?

The EC number is 677-540-4.

What is the DSSTox Substance ID of (3-Methoxy-2-trimethylsilyl-phenyl)trifluoromethanesulfonate?

The DSSTox Substance ID is DTXSID90452332.

Is (3-Methoxy-2-trimethylsilyl-phenyl)trifluoromethanesulfonate a canonicalized compound?

Yes, it is a canonicalized compound.

Synthetic Use

Downstream Synthesis Route 1

• 2591-86-8
• 217813-03-1

• 32040-06-5
• 148-53-8

Reference: [1] Tetrahedron, 2012, vol. 68, # 1, p. 179 - 189

Downstream Synthesis Route 2

• 68-12-2
• 217813-03-1

• 148-53-8

Reference: [1] Tetrahedron, 2012, vol. 68, # 1, p. 179 - 189

Downstream Synthesis Route 3

• 5464-77-7
• 217813-03-1

• 56511-50-3
• 148-53-8

Reference: [1] Tetrahedron, 2012, vol. 68, # 1, p. 179 - 189

Downstream Synthesis Route 4

• 62-53-3
• 217813-03-1

• 101-16-6

Reference: [1]Journal of Organic Chemistry,2006,vol. 71,p. 3198 - 3209
[2]Organic Letters,2003,vol. 5,p. 4673 - 4675

Downstream Synthesis Route 5

• 23040-22-4
• 217813-03-1

• 874898-04-1

Reference: [1]Yoshida, Hiroto; Watanabe, Masahiko; Ohshita, Joji; Kunai, Atsutaka
[Chemistry Letters, 2005, vol. 34, # 11, p. 1538 - 1539]

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