3-酮戊酸三甲基硅基酯
TL;DR: 3-酮戊酸三甲基硅基酯 (CAS 959085-77-9) is a chemical compound with molecular formula C8H16O3Si and molecular weight 188.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-酮戊酸三甲基硅基酯
trimethylsilyl 3-oxopentanoate
Also Known As: 3-Ketovaleric acid, TMS, 3-Oxopentanoic acid, TMS, trimethylsilyl 3-oxopentanoate, Pentanoic acid, 3-oxo-, trimethylsilyl ester
| Molecular Formula | C8H16O3Si |
|---|---|
| Molecular Weight | 188.09 g/mol |
| LogP | 1.7337 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 188.08687 |
| Heavy Atoms | 12 |
| Complexity | 181.0 |
Chemical Identifiers
| CAS Number | 959085-77-9 |
|---|---|
| SMILES | CCC(=O)CC(=O)O[Si](C)(C)C |
| InChIKey | BOPHYICVYUYPGN-UHFFFAOYSA-N |
Product Overview
3-酮戊酸三甲基硅基酯 (CAS 959085-77-9), with molecular formula C8H16O3Si and molecular weight 188.09 g/mol. IUPAC: trimethylsilyl 3-oxopentanoate.
Chemical Property Profile of 3-酮戊酸三甲基硅基酯
Property Insights of 3-酮戊酸三甲基硅基酯
The XLogP value of 1.7337 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-酮戊酸三甲基硅基酯. With a topological polar surface area (TPSA) of 43.4 Ų, 3-酮戊酸三甲基硅基酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-酮戊酸三甲基硅基酯 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-酮戊酸三甲基硅基酯?
The CAS number of 3-酮戊酸三甲基硅基酯 is 959085-77-9.
What is the molecular formula of 3-酮戊酸三甲基硅基酯?
The molecular formula of 3-酮戊酸三甲基硅基酯 is C8H16O3Si.
What is the molecular weight of 3-酮戊酸三甲基硅基酯?
The molecular weight of 3-酮戊酸三甲基硅基酯 is 188.09 g/mol.
Where can I buy 3-酮戊酸三甲基硅基酯?
You can request a quote for 3-酮戊酸三甲基硅基酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-酮戊酸三甲基硅基酯?
Yes, KEHONG BIO provides custom synthesis services for 3-酮戊酸三甲基硅基酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.