Benzoic acid, 3,4,5-trimethoxy-, (3,4,5-trimethoxyphenyl)methyl ester
TL;DR: Benzoic acid, 3,4,5-trimethoxy-, (3,4,5-trimethoxyphenyl)methyl ester (CAS 92085-78-4) is a chemical compound with molecular formula C20H24O8 and molecular weight 392.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,4,5-trimethoxyphenyl)methyl 3,4,5-trimethoxybenzoate
Also Known As: (3,4,5-trimethoxyphenyl)methyl 3,4,5-trimethoxybenzoate, Benzoic acid, 3,4,5-trimethoxy-, (3,4,5-trimethoxyphenyl)methyl ester, 5-Pyrimidinecarboxylic acid,4-phenyl-,tridecyl ester
| Molecular Formula | C20H24O8 |
|---|---|
| Molecular Weight | 392.15 g/mol |
| LogP | 3.0952 |
| Topological Polar Surface Area | 81.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 392.14713 |
| Heavy Atoms | 28 |
| Complexity | 780.9408 |
Chemical Identifiers
| CAS Number | 92085-78-4 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)COC(=O)C2=CC(=C(C(=C2)OC)OC)OC |
Product Overview
Benzoic acid, 3,4,5-trimethoxy-, (3,4,5-trimethoxyphenyl)methyl ester (CAS 92085-78-4), with molecular formula C20H24O8 and molecular weight 392.15 g/mol. IUPAC: (3,4,5-trimethoxyphenyl)methyl 3,4,5-trimethoxybenzoate.
Chemical Property Profile of Benzoic acid, 3,4,5-trimethoxy-, (3,4,5-trimethoxyphenyl)methyl ester
Property Insights of Benzoic acid, 3,4,5-trimethoxy-, (3,4,5-trimethoxyphenyl)methyl ester
The XLogP value of 3.0952 indicates that Benzoic acid, 3,4,5-trimethoxy-, (3,4,5-trimethoxyphenyl)methyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.68 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 3,4,5-trimethoxy-, (3,4,5-trimethoxyphenyl)methyl ester. Following Lipinski's Rule of Five, Benzoic acid, 3,4,5-trimethoxy-, (3,4,5-trimethoxyphenyl)methyl ester 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 Benzoic acid, 3,4,5-trimethoxy-, (3,4,5-trimethoxyphenyl)methyl ester?
The CAS number of Benzoic acid, 3,4,5-trimethoxy-, (3,4,5-trimethoxyphenyl)methyl ester is 92085-78-4.
What is the molecular formula of Benzoic acid, 3,4,5-trimethoxy-, (3,4,5-trimethoxyphenyl)methyl ester?
The molecular formula of Benzoic acid, 3,4,5-trimethoxy-, (3,4,5-trimethoxyphenyl)methyl ester is C20H24O8.
What is the molecular weight of Benzoic acid, 3,4,5-trimethoxy-, (3,4,5-trimethoxyphenyl)methyl ester?
The molecular weight of Benzoic acid, 3,4,5-trimethoxy-, (3,4,5-trimethoxyphenyl)methyl ester is 392.15 g/mol.
Where can I buy Benzoic acid, 3,4,5-trimethoxy-, (3,4,5-trimethoxyphenyl)methyl ester?
You can request a quote for Benzoic acid, 3,4,5-trimethoxy-, (3,4,5-trimethoxyphenyl)methyl 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, 3,4,5-trimethoxy-, (3,4,5-trimethoxyphenyl)methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 3,4,5-trimethoxy-, (3,4,5-trimethoxyphenyl)methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.