7-O-(Triethylsilyl) Baccatin III
TL;DR: 7-O-(Triethylsilyl) Baccatin III (CAS 115437-21-3) is a chemical compound with molecular formula C37H52O11Si and molecular weight 700.3279 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(1S,2S,3R,4S,7R,9S,10S,12R,15S)-4,12-diacetyloxy-1,15-dihydroxy-10,14,17,17-tetramethyl-11-oxo-9-triethylsilyloxy-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] benzoate
Also Known As: 7-O-(Triethylsilyl) Baccatin III, 7-(Triethylsilyl)baccatin III, 7-O-(Triethylsilyl)baccatin III, 7-Triethylsily-Baccatin? cento, 7-(Triethylsilyl)-baccatin III
Technical Specifications
| Molecular Formula | C37H52O11Si |
| Molecular Weight | 700.3279 g/mol |
| XLogP | 4.6821 |
| Topological Polar Surface Area (TPSA) | 155.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 12 |
| Exact Mass | 700.3279 Da |
| Heavy Atoms | 49 |
| Complexity | 1360.0 |
| SMILES | CC[Si](CC)(CC)O[C@H]1C[C@@H]2[C@@](CO2)([C@@H]3[C@@]1(C(=O)[C@@H](C4=C([C@H](C[C@@]([C@H]3OC(=O)C5=CC=CC=C5)(C4(C)C)O)O)C)OC(=O)C)C)OC(=O)C |
| InChIKey | WHXLTBRGUWTBQP-UZBMNOCMSA-N |
Chemical Property Profile of 7-O-(Triethylsilyl) Baccatin III
Property Insights of 7-O-(Triethylsilyl) Baccatin III
The XLogP value of 4.6821 indicates that 7-O-(Triethylsilyl) Baccatin III is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 155.0 Ų indicates high polarity, suggesting 7-O-(Triethylsilyl) Baccatin III may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 7-O-(Triethylsilyl) Baccatin III has 2 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 7-O-(Triethylsilyl) Baccatin III?
The CAS number of 7-O-(Triethylsilyl) Baccatin III is 115437-21-3.
What is the molecular formula of 7-O-(Triethylsilyl) Baccatin III?
The molecular formula of 7-O-(Triethylsilyl) Baccatin III is C37H52O11Si.
What is the molecular weight of 7-O-(Triethylsilyl) Baccatin III?
The molecular weight of 7-O-(Triethylsilyl) Baccatin III is 700.3279 g/mol.
Where can I buy 7-O-(Triethylsilyl) Baccatin III?
You can request a quote for 7-O-(Triethylsilyl) Baccatin III directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 7-O-(Triethylsilyl) Baccatin III?
Yes, CoreyChem provides custom synthesis services for 7-O-(Triethylsilyl) Baccatin III and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.