2,6-Diacetoxybenzoic acid
TL;DR: 2,6-Diacetoxybenzoic acid (CAS 3144-59-0) is a chemical compound with molecular formula C11H10O6 and molecular weight 238.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-diacetyloxybenzoic acid
Also Known As: 2,6-diacetoxybenzoic acid, 2,6-diacetyloxybenzoic Acid, 2,6-Diacetoxy-benzoesaeure, 2,6-Bis(acetyloxy)benzoic acid, Benzoic acid, 2,6-bis(acetyloxy)-
| Molecular Formula | C11H10O6 |
|---|---|
| Molecular Weight | 238.05 g/mol |
| LogP | 1.2354 |
| Topological Polar Surface Area | 89.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 238.04774 |
| Heavy Atoms | 17 |
| Complexity | 442.60004 |
Chemical Identifiers
| CAS Number | 3144-59-0 |
|---|---|
| SMILES | CC(=O)OC1=C(C(=CC=C1)OC(=O)C)C(=O)O |
Product Overview
2,6-Diacetoxybenzoic acid (CAS 3144-59-0), with molecular formula C11H10O6 and molecular weight 238.05 g/mol. IUPAC: 2,6-diacetyloxybenzoic acid.
Chemical Property Profile of 2,6-Diacetoxybenzoic acid
Property Insights of 2,6-Diacetoxybenzoic acid
The XLogP value of 1.2354 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,6-Diacetoxybenzoic acid. The TPSA of 89.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,6-Diacetoxybenzoic acid. Following Lipinski's Rule of Five, 2,6-Diacetoxybenzoic acid has 1 hydrogen bond donor(s) and 5 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 2,6-Diacetoxybenzoic acid?
The CAS number of 2,6-Diacetoxybenzoic acid is 3144-59-0.
What is the molecular formula of 2,6-Diacetoxybenzoic acid?
The molecular formula of 2,6-Diacetoxybenzoic acid is C11H10O6.
What is the molecular weight of 2,6-Diacetoxybenzoic acid?
The molecular weight of 2,6-Diacetoxybenzoic acid is 238.05 g/mol.
Where can I buy 2,6-Diacetoxybenzoic acid?
You can request a quote for 2,6-Diacetoxybenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Diacetoxybenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Diacetoxybenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.