Triacetylphloroglucinol
TL;DR: Triacetylphloroglucinol (CAS 2161-87-7) 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.
1-(3,5-diacetyl-2,4,6-trihydroxyphenyl)ethanone
Also Known As: triacetylphloroglucinol, 2,4,6-Triacetylphloroglucinol, 1-(3,5-diacetyl-2,4,6-trihydroxyphenyl)ethanone, Phloroglucinol 2,4,6-Triacetate, 1,1',1''-(2,4,6-Trihydroxybenzene-1,3,5-triyl)triethanone
| Molecular Formula | C12H12O6 |
|---|---|
| Molecular Weight | 252.06 g/mol |
| LogP | 1.4112 |
| Topological Polar Surface Area | 111.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 252.06339 |
| Heavy Atoms | 18 |
| Complexity | 468.39395 |
Chemical Identifiers
| CAS Number | 2161-87-7 |
|---|---|
| SMILES | CC(=O)C1=C(C(=C(C(=C1O)C(=O)C)O)C(=O)C)O |
Product Overview
Triacetylphloroglucinol (CAS 2161-87-7), with molecular formula C12H12O6 and molecular weight 252.06 g/mol. IUPAC: 1-(3,5-diacetyl-2,4,6-trihydroxyphenyl)ethanone.
Chemical Property Profile of Triacetylphloroglucinol
Property Insights of Triacetylphloroglucinol
The XLogP value of 1.4112 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Triacetylphloroglucinol. The TPSA of 111.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Triacetylphloroglucinol. Following Lipinski's Rule of Five, Triacetylphloroglucinol has 3 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 Triacetylphloroglucinol?
The CAS number of Triacetylphloroglucinol is 2161-87-7.
What is the molecular formula of Triacetylphloroglucinol?
The molecular formula of Triacetylphloroglucinol is C12H12O6.
What is the molecular weight of Triacetylphloroglucinol?
The molecular weight of Triacetylphloroglucinol is 252.06 g/mol.
Where can I buy Triacetylphloroglucinol?
You can request a quote for Triacetylphloroglucinol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Triacetylphloroglucinol?
Yes, KEHONG BIO provides custom synthesis services for Triacetylphloroglucinol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.