Catechin Pentaacetate
TL;DR: Catechin Pentaacetate (CAS 16198-01-9) is a chemical compound with molecular formula C25H24O11 and molecular weight 500.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3S)-5,7-diacetyloxy-2-(3,4-diacetyloxyphenyl)-3,4-dihydro-2H-chromen-3-yl] acetate
Also Known As: Catechin pentaacetate, CatechinPentaacetate, (+)-Catechin pentaacetate, (+)-Catechin-pentaacetate, Catechol pentaacetate
| Molecular Formula | C25H24O11 |
|---|---|
| Molecular Weight | 500.13 g/mol |
| LogP | 2.9957 |
| Topological Polar Surface Area | 140.73 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 6 |
| Exact Mass | 500.13187 |
| Heavy Atoms | 36 |
| Complexity | 1230.7516 |
Chemical Identifiers
| CAS Number | 16198-01-9 |
|---|---|
| SMILES | CC(=O)O[C@H]1CC2=C(C=C(C=C2OC(=O)C)OC(=O)C)O[C@@H]1C3=CC(=C(C=C3)OC(=O)C)OC(=O)C |
Product Overview
Catechin Pentaacetate (CAS 16198-01-9), with molecular formula C25H24O11 and molecular weight 500.13 g/mol. IUPAC: [(2R,3S)-5,7-diacetyloxy-2-(3,4-diacetyloxyphenyl)-3,4-dihydro-2H-chromen-3-yl] acetate.
Chemical Property Profile of Catechin Pentaacetate
Property Insights of Catechin Pentaacetate
The XLogP value of 2.9957 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Catechin Pentaacetate. The TPSA of 140.73 Ų indicates high polarity, suggesting Catechin Pentaacetate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Catechin Pentaacetate has 0 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Catechin Pentaacetate?
The CAS number of Catechin Pentaacetate is 16198-01-9.
What is the molecular formula of Catechin Pentaacetate?
The molecular formula of Catechin Pentaacetate is C25H24O11.
What is the molecular weight of Catechin Pentaacetate?
The molecular weight of Catechin Pentaacetate is 500.13 g/mol.
Where can I buy Catechin Pentaacetate?
You can request a quote for Catechin Pentaacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Catechin Pentaacetate?
Yes, KEHONG BIO provides custom synthesis services for Catechin Pentaacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.