Guaiacol Carbonate
TL;DR: Guaiacol Carbonate (CAS 553-17-3) is a chemical compound with molecular formula C15H14O5 and molecular weight 274.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2-methoxyphenyl) carbonate
Also Known As: GUAIACOL CARBONATE, Bis(2-methoxyphenyl) carbonate, Duotal, Tussophob, guaiacolcarbonate
| Molecular Formula | C15H14O5 |
|---|---|
| Molecular Weight | 274.08 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 54.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 274.08414 |
| Heavy Atoms | 20 |
| Complexity | 279.0 |
Chemical Identifiers
| CAS Number | 553-17-3 |
|---|---|
| SMILES | COC1=CC=CC=C1OC(=O)OC2=CC=CC=C2OC |
| InChIKey | ORUJFMPWKPVXLZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Guaiacol Carbonate (CAS 553-17-3), with molecular formula C15H14O5 and molecular weight 274.08 g/mol. IUPAC: bis(2-methoxyphenyl) carbonate.
Chemical Property Profile of Guaiacol Carbonate
Property Insights of Guaiacol Carbonate
The XLogP value of 3.3 indicates that Guaiacol Carbonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.0 Ų, Guaiacol Carbonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Guaiacol Carbonate has 0 hydrogen bond donor(s) and 5 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 Guaiacol Carbonate?
The CAS number of Guaiacol Carbonate is 553-17-3.
What is the molecular formula of Guaiacol Carbonate?
The molecular formula of Guaiacol Carbonate is C15H14O5.
What is the molecular weight of Guaiacol Carbonate?
The molecular weight of Guaiacol Carbonate is 274.08 g/mol.
Where can I buy Guaiacol Carbonate?
You can request a quote for Guaiacol Carbonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Guaiacol Carbonate?
Yes, KEHONG BIO provides custom synthesis services for Guaiacol Carbonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.