Pentanoic acid, 4-oxo-, trimethylsilyl ester
TL;DR: Pentanoic acid, 4-oxo-, trimethylsilyl ester (CAS 55557-12-5) 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.
trimethylsilyl 4-oxopentanoate
Also Known As: Trimethylsilyl 4-oxopentanoate, Levulinic acid, TMS derivative, Laevulic acid, trimethylsilyl ester, Trimethylsilyl 4-oxopentanoate #, Levulinic acid 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 | 55557-12-5 |
|---|---|
| SMILES | CC(=O)CCC(=O)O[Si](C)(C)C |
| InChIKey | SKSOOBJAPLSIMV-UHFFFAOYSA-N |
Product Overview
Pentanoic acid, 4-oxo-, trimethylsilyl ester (CAS 55557-12-5), with molecular formula C8H16O3Si and molecular weight 188.09 g/mol. IUPAC: trimethylsilyl 4-oxopentanoate.
Chemical Property Profile of Pentanoic acid, 4-oxo-, trimethylsilyl ester
Property Insights of Pentanoic acid, 4-oxo-, trimethylsilyl ester
The XLogP value of 1.7337 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pentanoic acid, 4-oxo-, trimethylsilyl ester. With a topological polar surface area (TPSA) of 43.4 Ų, Pentanoic acid, 4-oxo-, trimethylsilyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pentanoic acid, 4-oxo-, trimethylsilyl ester 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 Pentanoic acid, 4-oxo-, trimethylsilyl ester?
The CAS number of Pentanoic acid, 4-oxo-, trimethylsilyl ester is 55557-12-5.
What is the molecular formula of Pentanoic acid, 4-oxo-, trimethylsilyl ester?
The molecular formula of Pentanoic acid, 4-oxo-, trimethylsilyl ester is C8H16O3Si.
What is the molecular weight of Pentanoic acid, 4-oxo-, trimethylsilyl ester?
The molecular weight of Pentanoic acid, 4-oxo-, trimethylsilyl ester is 188.09 g/mol.
Where can I buy Pentanoic acid, 4-oxo-, trimethylsilyl ester?
You can request a quote for Pentanoic acid, 4-oxo-, trimethylsilyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pentanoic acid, 4-oxo-, trimethylsilyl ester?
Yes, KEHONG BIO provides custom synthesis services for Pentanoic acid, 4-oxo-, trimethylsilyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.