Benzoic acid, 3,4-dimethoxy-, 4-acetyl-1,3-phenylene ester
TL;DR: Benzoic acid, 3,4-dimethoxy-, 4-acetyl-1,3-phenylene ester (CAS 194784-74-2) is a chemical compound with molecular formula C26H24O9 and molecular weight 480.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-acetyl-3-(3,4-dimethoxybenzoyl)oxyphenyl] 3,4-dimethoxybenzoate
Also Known As: 4-Acetyl-1,3-phenylene bis(3,4-dimethoxybenzoate), Benzoic acid, 3,4-dimethoxy-, 4-acetyl-1,3-phenylene ester, 2-acetyl-5-[(3,4-dimethoxybenzoyl)oxy]phenyl 3,4-dimethoxybenzoate, [4-acetyl-3-(3,4-dimethoxybenzoyl)oxyphenyl] 3,4-dimethoxybenzoate, [2-acetyl-5-(3,4-dimethoxybenzoyl)oxy-phenyl] 3,4-dimethoxybenzoate
| Molecular Formula | C26H24O9 |
|---|---|
| Molecular Weight | 480.14 g/mol |
| LogP | 4.362 |
| Topological Polar Surface Area | 106.59 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 480.14203 |
| Heavy Atoms | 35 |
| Complexity | 1263.6725 |
Chemical Identifiers
| CAS Number | 194784-74-2 |
|---|---|
| SMILES | CC(=O)C1=C(C=C(C=C1)OC(=O)C2=CC(=C(C=C2)OC)OC)OC(=O)C3=CC(=C(C=C3)OC)OC |
Product Overview
Benzoic acid, 3,4-dimethoxy-, 4-acetyl-1,3-phenylene ester (CAS 194784-74-2), with molecular formula C26H24O9 and molecular weight 480.14 g/mol. IUPAC: [4-acetyl-3-(3,4-dimethoxybenzoyl)oxyphenyl] 3,4-dimethoxybenzoate.
Chemical Property Profile of Benzoic acid, 3,4-dimethoxy-, 4-acetyl-1,3-phenylene ester
Property Insights of Benzoic acid, 3,4-dimethoxy-, 4-acetyl-1,3-phenylene ester
The XLogP value of 4.362 indicates that Benzoic acid, 3,4-dimethoxy-, 4-acetyl-1,3-phenylene ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.59 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 3,4-dimethoxy-, 4-acetyl-1,3-phenylene ester. Following Lipinski's Rule of Five, Benzoic acid, 3,4-dimethoxy-, 4-acetyl-1,3-phenylene ester has 0 hydrogen bond donor(s) and 9 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 Benzoic acid, 3,4-dimethoxy-, 4-acetyl-1,3-phenylene ester?
The CAS number of Benzoic acid, 3,4-dimethoxy-, 4-acetyl-1,3-phenylene ester is 194784-74-2.
What is the molecular formula of Benzoic acid, 3,4-dimethoxy-, 4-acetyl-1,3-phenylene ester?
The molecular formula of Benzoic acid, 3,4-dimethoxy-, 4-acetyl-1,3-phenylene ester is C26H24O9.
What is the molecular weight of Benzoic acid, 3,4-dimethoxy-, 4-acetyl-1,3-phenylene ester?
The molecular weight of Benzoic acid, 3,4-dimethoxy-, 4-acetyl-1,3-phenylene ester is 480.14 g/mol.
Where can I buy Benzoic acid, 3,4-dimethoxy-, 4-acetyl-1,3-phenylene ester?
You can request a quote for Benzoic acid, 3,4-dimethoxy-, 4-acetyl-1,3-phenylene ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 3,4-dimethoxy-, 4-acetyl-1,3-phenylene ester?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 3,4-dimethoxy-, 4-acetyl-1,3-phenylene ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.