Methyl 4-methoxy-3-trimethylsilyloxybenzoate
TL;DR: Methyl 4-methoxy-3-trimethylsilyloxybenzoate (CAS 55590-91-5) is a chemical compound with molecular formula C12H18O4Si and molecular weight 254.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-methoxy-3-trimethylsilyloxybenzoate
Also Known As: Methyl isovanillate, TMS derivative, 4-Methoxy-3- benzoicacidmethylester, methyl 4-methoxy-3-trimethylsilyloxybenzoate, Methyl 4-methoxy-3-[(trimethylsilyl)oxy]benzoate, 4-Methoxy-3-(trimethylsiloxy)benzoic acid methyl ester
| Molecular Formula | C12H18O4Si |
|---|---|
| Molecular Weight | 254.10 g/mol |
| LogP | 2.6955 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 254.09744 |
| Heavy Atoms | 17 |
| Complexity | 262.0 |
Chemical Identifiers
| CAS Number | 55590-91-5 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C(=O)OC)O[Si](C)(C)C |
| InChIKey | KBCFBQHJWCDVHH-UHFFFAOYSA-N |
Product Overview
Methyl 4-methoxy-3-trimethylsilyloxybenzoate (CAS 55590-91-5), with molecular formula C12H18O4Si and molecular weight 254.10 g/mol. IUPAC: methyl 4-methoxy-3-trimethylsilyloxybenzoate.
Chemical Property Profile of Methyl 4-methoxy-3-trimethylsilyloxybenzoate
Property Insights of Methyl 4-methoxy-3-trimethylsilyloxybenzoate
The XLogP value of 2.6955 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-methoxy-3-trimethylsilyloxybenzoate. With a topological polar surface area (TPSA) of 44.8 Ų, Methyl 4-methoxy-3-trimethylsilyloxybenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 4-methoxy-3-trimethylsilyloxybenzoate has 0 hydrogen bond donor(s) and 4 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 Methyl 4-methoxy-3-trimethylsilyloxybenzoate?
The CAS number of Methyl 4-methoxy-3-trimethylsilyloxybenzoate is 55590-91-5.
What is the molecular formula of Methyl 4-methoxy-3-trimethylsilyloxybenzoate?
The molecular formula of Methyl 4-methoxy-3-trimethylsilyloxybenzoate is C12H18O4Si.
What is the molecular weight of Methyl 4-methoxy-3-trimethylsilyloxybenzoate?
The molecular weight of Methyl 4-methoxy-3-trimethylsilyloxybenzoate is 254.10 g/mol.
Where can I buy Methyl 4-methoxy-3-trimethylsilyloxybenzoate?
You can request a quote for Methyl 4-methoxy-3-trimethylsilyloxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-methoxy-3-trimethylsilyloxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-methoxy-3-trimethylsilyloxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.