Benzoic acid, p-(trimethylsiloxy)-, methyl ester
TL;DR: Benzoic acid, p-(trimethylsiloxy)-, methyl ester (CAS 27739-17-9) is a chemical compound with molecular formula C11H16O3Si and molecular weight 224.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-trimethylsilyloxybenzoate
Also Known As: methyl 4-trimethylsilyloxybenzoate, Methyl 4-[(trimethylsilyl)oxy]benzoate, 4-(Methoxycarbonyl)phenol, TMS derivative, Benzoic acid, p-(trimethylsiloxy)-, methyl ester, Methyl 4-[(trimethylsilyl)oxy]benzoate #
| Molecular Formula | C11H16O3Si |
|---|---|
| Molecular Weight | 224.09 g/mol |
| LogP | 2.6869 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 224.08687 |
| Heavy Atoms | 15 |
| Complexity | 214.0 |
Chemical Identifiers
| CAS Number | 27739-17-9 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)O[Si](C)(C)C |
| InChIKey | UGFXQBRWNPEHCX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzoic acid, p-(trimethylsiloxy)-, methyl ester (CAS 27739-17-9), with molecular formula C11H16O3Si and molecular weight 224.09 g/mol. IUPAC: methyl 4-trimethylsilyloxybenzoate.
Chemical Property Profile of Benzoic acid, p-(trimethylsiloxy)-, methyl ester
Property Insights of Benzoic acid, p-(trimethylsiloxy)-, methyl ester
The XLogP value of 2.6869 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, p-(trimethylsiloxy)-, methyl ester. With a topological polar surface area (TPSA) of 35.5 Ų, Benzoic acid, p-(trimethylsiloxy)-, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoic acid, p-(trimethylsiloxy)-, methyl 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 Benzoic acid, p-(trimethylsiloxy)-, methyl ester?
The CAS number of Benzoic acid, p-(trimethylsiloxy)-, methyl ester is 27739-17-9.
What is the molecular formula of Benzoic acid, p-(trimethylsiloxy)-, methyl ester?
The molecular formula of Benzoic acid, p-(trimethylsiloxy)-, methyl ester is C11H16O3Si.
What is the molecular weight of Benzoic acid, p-(trimethylsiloxy)-, methyl ester?
The molecular weight of Benzoic acid, p-(trimethylsiloxy)-, methyl ester is 224.09 g/mol.
Where can I buy Benzoic acid, p-(trimethylsiloxy)-, methyl ester?
You can request a quote for Benzoic acid, p-(trimethylsiloxy)-, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, p-(trimethylsiloxy)-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, p-(trimethylsiloxy)-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.