Benzyl alcohol, 2,3,5-trihydroxy-, tetraacetate
TL;DR: Benzyl alcohol, 2,3,5-trihydroxy-, tetraacetate (CAS 5831-39-0) is a chemical compound with molecular formula C15H16O8 and molecular weight 324.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,3,5-triacetyloxyphenyl)methyl acetate
Also Known As: Benzyl alcohol, 2,3,5-trihydroxy-, tetraacetate, (2,3,5-triacetyloxyphenyl)methyl acetate, 6-[methyl]-1,2,4-benzenetrioltriacetate, 6-[ methyl]-1,2,4-benzenetrioltriacetate, [2,3,5-tris(acetyloxy)phenyl]methyl acetate
| Molecular Formula | C15H16O8 |
|---|---|
| Molecular Weight | 324.08 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 105.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 324.0845 |
| Heavy Atoms | 23 |
| Complexity | 472.0 |
Chemical Identifiers
| CAS Number | 5831-39-0 |
|---|---|
| SMILES | CC(=O)OCC1=C(C(=CC(=C1)OC(=O)C)OC(=O)C)OC(=O)C |
| InChIKey | SGKQWGRPNGEHNE-UHFFFAOYSA-N |
Product Overview
Benzyl alcohol, 2,3,5-trihydroxy-, tetraacetate (CAS 5831-39-0), with molecular formula C15H16O8 and molecular weight 324.08 g/mol. IUPAC: (2,3,5-triacetyloxyphenyl)methyl acetate.
Chemical Property Profile of Benzyl alcohol, 2,3,5-trihydroxy-, tetraacetate
Property Insights of Benzyl alcohol, 2,3,5-trihydroxy-, tetraacetate
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzyl alcohol, 2,3,5-trihydroxy-, tetraacetate. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzyl alcohol, 2,3,5-trihydroxy-, tetraacetate. Following Lipinski's Rule of Five, Benzyl alcohol, 2,3,5-trihydroxy-, tetraacetate has 0 hydrogen bond donor(s) and 8 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 Benzyl alcohol, 2,3,5-trihydroxy-, tetraacetate?
The CAS number of Benzyl alcohol, 2,3,5-trihydroxy-, tetraacetate is 5831-39-0.
What is the molecular formula of Benzyl alcohol, 2,3,5-trihydroxy-, tetraacetate?
The molecular formula of Benzyl alcohol, 2,3,5-trihydroxy-, tetraacetate is C15H16O8.
What is the molecular weight of Benzyl alcohol, 2,3,5-trihydroxy-, tetraacetate?
The molecular weight of Benzyl alcohol, 2,3,5-trihydroxy-, tetraacetate is 324.08 g/mol.
Where can I buy Benzyl alcohol, 2,3,5-trihydroxy-, tetraacetate?
You can request a quote for Benzyl alcohol, 2,3,5-trihydroxy-, tetraacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl alcohol, 2,3,5-trihydroxy-, tetraacetate?
Yes, KEHONG BIO provides custom synthesis services for Benzyl alcohol, 2,3,5-trihydroxy-, tetraacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.