(1,1-Diphenyl-4-trimethylsilylbut-1-en-3-yn-2-yl) trifluoromethanesulfonate
TL;DR: (1,1-Diphenyl-4-trimethylsilylbut-1-en-3-yn-2-yl) trifluoromethanesulfonate (CAS 71451-05-3) is a chemical compound with molecular formula C20H19F3O3SSi and molecular weight 424.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1,1-diphenyl-4-trimethylsilylbut-1-en-3-yn-2-yl) trifluoromethanesulfonate
Also Known As: J1.731.248K, (1,1-diphenyl-4-trimethylsilylbut-1-en-3-yn-2-yl) trifluoromethanesulfonate, (1,1-diphenyl-4-trimethylsilylbut-1-en-3-yn-2-yl) trifluorom, 1,1-diphenyl-4-(trimethylsilyl)but-1-en-3-yn-2-yl trifluoromethanesulfonate, Trifluoromethanesulfonic acid 1-(diphenylmethylene)-3-(trimethylsilyl)propargyl ester
| Molecular Formula | C20H19F3O3SSi |
|---|---|
| Molecular Weight | 424.08 g/mol |
| LogP | 5.193 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 424.07764 |
| Heavy Atoms | 28 |
| Complexity | 714.0 |
Chemical Identifiers
| CAS Number | 71451-05-3 |
|---|---|
| SMILES | C[Si](C)(C)C#CC(=C(C1=CC=CC=C1)C2=CC=CC=C2)OS(=O)(=O)C(F)(F)F |
| InChIKey | JJCBFBLVZVUASG-UHFFFAOYSA-N |
Product Overview
(1,1-Diphenyl-4-trimethylsilylbut-1-en-3-yn-2-yl) trifluoromethanesulfonate (CAS 71451-05-3), with molecular formula C20H19F3O3SSi and molecular weight 424.08 g/mol. IUPAC: (1,1-diphenyl-4-trimethylsilylbut-1-en-3-yn-2-yl) trifluoromethanesulfonate.
Chemical Property Profile of (1,1-Diphenyl-4-trimethylsilylbut-1-en-3-yn-2-yl) trifluoromethanesulfonate
Property Insights of (1,1-Diphenyl-4-trimethylsilylbut-1-en-3-yn-2-yl) trifluoromethanesulfonate
The XLogP value of 5.193 indicates that (1,1-Diphenyl-4-trimethylsilylbut-1-en-3-yn-2-yl) trifluoromethanesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.8 Ų, (1,1-Diphenyl-4-trimethylsilylbut-1-en-3-yn-2-yl) trifluoromethanesulfonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1,1-Diphenyl-4-trimethylsilylbut-1-en-3-yn-2-yl) trifluoromethanesulfonate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (1,1-Diphenyl-4-trimethylsilylbut-1-en-3-yn-2-yl) trifluoromethanesulfonate?
The CAS number of (1,1-Diphenyl-4-trimethylsilylbut-1-en-3-yn-2-yl) trifluoromethanesulfonate is 71451-05-3.
What is the molecular formula of (1,1-Diphenyl-4-trimethylsilylbut-1-en-3-yn-2-yl) trifluoromethanesulfonate?
The molecular formula of (1,1-Diphenyl-4-trimethylsilylbut-1-en-3-yn-2-yl) trifluoromethanesulfonate is C20H19F3O3SSi.
What is the molecular weight of (1,1-Diphenyl-4-trimethylsilylbut-1-en-3-yn-2-yl) trifluoromethanesulfonate?
The molecular weight of (1,1-Diphenyl-4-trimethylsilylbut-1-en-3-yn-2-yl) trifluoromethanesulfonate is 424.08 g/mol.
Where can I buy (1,1-Diphenyl-4-trimethylsilylbut-1-en-3-yn-2-yl) trifluoromethanesulfonate?
You can request a quote for (1,1-Diphenyl-4-trimethylsilylbut-1-en-3-yn-2-yl) trifluoromethanesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1,1-Diphenyl-4-trimethylsilylbut-1-en-3-yn-2-yl) trifluoromethanesulfonate?
Yes, KEHONG BIO provides custom synthesis services for (1,1-Diphenyl-4-trimethylsilylbut-1-en-3-yn-2-yl) trifluoromethanesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.