Phloroglucinol triacetate
TL;DR: Phloroglucinol triacetate (CAS 2999-40-8) 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.
(3,5-diacetyloxyphenyl) acetate
Also Known As: Phloroglucinol triacetate, benzene-1,3,5-triyl triacetate, 1,3,5-triacetoxybenzene, Ethyl isocyanoacetate, Pholoroglucinol Triacetate
| Molecular Formula | C12H12O6 |
|---|---|
| Molecular Weight | 252.06 g/mol |
| LogP | 1.2 |
| 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 | 273.0 |
Chemical Identifiers
| CAS Number | 2999-40-8 |
|---|---|
| SMILES | CC(=O)OC1=CC(=CC(=C1)OC(=O)C)OC(=O)C |
| InChIKey | CLWKAMVDWLTMKD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Phloroglucinol triacetate (CAS 2999-40-8), with molecular formula C12H12O6 and molecular weight 252.06 g/mol. IUPAC: (3,5-diacetyloxyphenyl) acetate.
Chemical Property Profile of Phloroglucinol triacetate
Property Insights of Phloroglucinol triacetate
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phloroglucinol triacetate. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Phloroglucinol triacetate. Following Lipinski's Rule of Five, Phloroglucinol 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 Phloroglucinol triacetate?
The CAS number of Phloroglucinol triacetate is 2999-40-8.
What is the molecular formula of Phloroglucinol triacetate?
The molecular formula of Phloroglucinol triacetate is C12H12O6.
What is the molecular weight of Phloroglucinol triacetate?
The molecular weight of Phloroglucinol triacetate is 252.06 g/mol.
Where can I buy Phloroglucinol triacetate?
You can request a quote for Phloroglucinol triacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phloroglucinol triacetate?
Yes, KEHONG BIO provides custom synthesis services for Phloroglucinol triacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.