2,5-Bis(acetyloxy)benzoic acid
TL;DR: 2,5-Bis(acetyloxy)benzoic acid (CAS 1184-88-9) 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.
2,5-diacetyloxybenzoic acid
Also Known As: 2,5-bis(acetyloxy)benzoic acid, diacetylgentisic acid, 2,5-diacetyloxybenzoic acid, 2,5-DIACETOXYBENZOIC ACID, Benzoic acid,2,5-bis(acetyloxy)-
| Molecular Formula | C11H10O6 |
|---|---|
| Molecular Weight | 238.05 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 89.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 238.04774 |
| Heavy Atoms | 17 |
| Complexity | 324.0 |
Chemical Identifiers
| CAS Number | 1184-88-9 |
|---|---|
| SMILES | CC(=O)OC1=CC(=C(C=C1)OC(=O)C)C(=O)O |
| InChIKey | ATWGXJGRRXIETI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,5-Bis(acetyloxy)benzoic acid (CAS 1184-88-9), with molecular formula C11H10O6 and molecular weight 238.05 g/mol. IUPAC: 2,5-diacetyloxybenzoic acid.
Chemical Property Profile of 2,5-Bis(acetyloxy)benzoic acid
Property Insights of 2,5-Bis(acetyloxy)benzoic acid
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,5-Bis(acetyloxy)benzoic acid. The TPSA of 89.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,5-Bis(acetyloxy)benzoic acid. Following Lipinski's Rule of Five, 2,5-Bis(acetyloxy)benzoic acid has 1 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 2,5-Bis(acetyloxy)benzoic acid?
The CAS number of 2,5-Bis(acetyloxy)benzoic acid is 1184-88-9.
What is the molecular formula of 2,5-Bis(acetyloxy)benzoic acid?
The molecular formula of 2,5-Bis(acetyloxy)benzoic acid is C11H10O6.
What is the molecular weight of 2,5-Bis(acetyloxy)benzoic acid?
The molecular weight of 2,5-Bis(acetyloxy)benzoic acid is 238.05 g/mol.
Where can I buy 2,5-Bis(acetyloxy)benzoic acid?
You can request a quote for 2,5-Bis(acetyloxy)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Bis(acetyloxy)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Bis(acetyloxy)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.