trimethylsilyl 4-oxo-4-phenylbut-2-enoate
TL;DR: trimethylsilyl 4-oxo-4-phenylbut-2-enoate (CAS 25432-36-4) is a chemical compound with molecular formula C13H16O3Si and molecular weight 248.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trimethylsilyl 4-oxo-4-phenylbut-2-enoate
Also Known As: trimethylsilyl 4-oxo-4-phenylbut-2-enoate, Acrylic acid, 3-benzoyl-, trimethylsilyl ester
| Molecular Formula | C13H16O3Si |
|---|---|
| Molecular Weight | 248.09 g/mol |
| LogP | 2.8036 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 248.08687 |
| Heavy Atoms | 17 |
| Complexity | 309.0 |
Chemical Identifiers
| CAS Number | 25432-36-4 |
|---|---|
| SMILES | C[Si](C)(C)OC(=O)C=CC(=O)C1=CC=CC=C1 |
| InChIKey | JFXJZKBGIYVKKR-UHFFFAOYSA-N |
Product Overview
trimethylsilyl 4-oxo-4-phenylbut-2-enoate (CAS 25432-36-4), with molecular formula C13H16O3Si and molecular weight 248.09 g/mol. IUPAC: trimethylsilyl 4-oxo-4-phenylbut-2-enoate.
Chemical Property Profile of trimethylsilyl 4-oxo-4-phenylbut-2-enoate
Property Insights of trimethylsilyl 4-oxo-4-phenylbut-2-enoate
The XLogP value of 2.8036 suggests moderate lipophilicity, balancing water solubility and membrane permeability for trimethylsilyl 4-oxo-4-phenylbut-2-enoate. With a topological polar surface area (TPSA) of 43.4 Ų, trimethylsilyl 4-oxo-4-phenylbut-2-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, trimethylsilyl 4-oxo-4-phenylbut-2-enoate 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 trimethylsilyl 4-oxo-4-phenylbut-2-enoate?
The CAS number of trimethylsilyl 4-oxo-4-phenylbut-2-enoate is 25432-36-4.
What is the molecular formula of trimethylsilyl 4-oxo-4-phenylbut-2-enoate?
The molecular formula of trimethylsilyl 4-oxo-4-phenylbut-2-enoate is C13H16O3Si.
What is the molecular weight of trimethylsilyl 4-oxo-4-phenylbut-2-enoate?
The molecular weight of trimethylsilyl 4-oxo-4-phenylbut-2-enoate is 248.09 g/mol.
Where can I buy trimethylsilyl 4-oxo-4-phenylbut-2-enoate?
You can request a quote for trimethylsilyl 4-oxo-4-phenylbut-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for trimethylsilyl 4-oxo-4-phenylbut-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for trimethylsilyl 4-oxo-4-phenylbut-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.