Pyrogallol triacetate
TL;DR: Pyrogallol triacetate (CAS 525-52-0) is a chemical compound with molecular formula C12H12O6 and molecular weight 252.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,3-diacetyloxyphenyl) acetate
Also Known As: Pyrogallol triacetate, Acetpyrogall, Lenigallol, 1,2,3-Triacetoxybenzene, Pyracetol
| Molecular Formula | C12H12O6 |
|---|---|
| Molecular Weight | 252.06 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 252.06339 |
| Heavy Atoms | 18 |
| Complexity | 313.0 |
Chemical Identifiers
| CAS Number | 525-52-0 |
|---|---|
| SMILES | CC(=O)OC1=C(C(=CC=C1)OC(=O)C)OC(=O)C |
| InChIKey | AQGLTPNHAAVOKN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pyrogallol triacetate (CAS 525-52-0), with molecular formula C12H12O6 and molecular weight 252.06 g/mol. IUPAC: (2,3-diacetyloxyphenyl) acetate.
Chemical Property Profile of Pyrogallol triacetate
Property Insights of Pyrogallol triacetate
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrogallol triacetate. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Pyrogallol triacetate. Following Lipinski's Rule of Five, Pyrogallol triacetate has 0 hydrogen bond donor(s) and 6 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 Pyrogallol triacetate?
The CAS number of Pyrogallol triacetate is 525-52-0.
What is the molecular formula of Pyrogallol triacetate?
The molecular formula of Pyrogallol triacetate is C12H12O6.
What is the molecular weight of Pyrogallol triacetate?
The molecular weight of Pyrogallol triacetate is 252.06 g/mol.
Where can I buy Pyrogallol triacetate?
You can request a quote for Pyrogallol triacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrogallol triacetate?
Yes, KEHONG BIO provides custom synthesis services for Pyrogallol triacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.