(1,1'-Biphenyl)-2,4',5-tricarboxylic acid, 2,4',5-trimethyl ester
TL;DR: (1,1'-Biphenyl)-2,4',5-tricarboxylic acid, 2,4',5-trimethyl ester (CAS 32741-92-7) is a chemical compound with molecular formula C18H16O6 and molecular weight 328.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 2-(4-methoxycarbonylphenyl)benzene-1,4-dicarboxylate
Also Known As: Trimethyl [1,1'-biphenyl]-2,4',5-tricarboxylate, trimethyl biphenyl-2,4',5-tricarboxylate, Trimethyl-2,4',5-Biphenyl-tricarboxylat, dimethyl 2-(4-methoxycarbonylphenyl)benzene-1,4-dicarboxylate, [1,1'-Biphenyl]-2,4',5-tricarboxylic acid, trimethyl ester
| Molecular Formula | C18H16O6 |
|---|---|
| Molecular Weight | 328.09 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 328.0947 |
| Heavy Atoms | 24 |
| Complexity | 466.0 |
Chemical Identifiers
| CAS Number | 32741-92-7 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)C2=C(C=CC(=C2)C(=O)OC)C(=O)OC |
| InChIKey | ZLRSGCDCVGSPKI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(1,1'-Biphenyl)-2,4',5-tricarboxylic acid, 2,4',5-trimethyl ester (CAS 32741-92-7), with molecular formula C18H16O6 and molecular weight 328.09 g/mol. IUPAC: dimethyl 2-(4-methoxycarbonylphenyl)benzene-1,4-dicarboxylate.
Chemical Property Profile of (1,1'-Biphenyl)-2,4',5-tricarboxylic acid, 2,4',5-trimethyl ester
Property Insights of (1,1'-Biphenyl)-2,4',5-tricarboxylic acid, 2,4',5-trimethyl ester
The XLogP value of 3.1 indicates that (1,1'-Biphenyl)-2,4',5-tricarboxylic acid, 2,4',5-trimethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for (1,1'-Biphenyl)-2,4',5-tricarboxylic acid, 2,4',5-trimethyl ester. Following Lipinski's Rule of Five, (1,1'-Biphenyl)-2,4',5-tricarboxylic acid, 2,4',5-trimethyl ester has 0 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 (1,1'-Biphenyl)-2,4',5-tricarboxylic acid, 2,4',5-trimethyl ester?
The CAS number of (1,1'-Biphenyl)-2,4',5-tricarboxylic acid, 2,4',5-trimethyl ester is 32741-92-7.
What is the molecular formula of (1,1'-Biphenyl)-2,4',5-tricarboxylic acid, 2,4',5-trimethyl ester?
The molecular formula of (1,1'-Biphenyl)-2,4',5-tricarboxylic acid, 2,4',5-trimethyl ester is C18H16O6.
What is the molecular weight of (1,1'-Biphenyl)-2,4',5-tricarboxylic acid, 2,4',5-trimethyl ester?
The molecular weight of (1,1'-Biphenyl)-2,4',5-tricarboxylic acid, 2,4',5-trimethyl ester is 328.09 g/mol.
Where can I buy (1,1'-Biphenyl)-2,4',5-tricarboxylic acid, 2,4',5-trimethyl ester?
You can request a quote for (1,1'-Biphenyl)-2,4',5-tricarboxylic acid, 2,4',5-trimethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1,1'-Biphenyl)-2,4',5-tricarboxylic acid, 2,4',5-trimethyl ester?
Yes, KEHONG BIO provides custom synthesis services for (1,1'-Biphenyl)-2,4',5-tricarboxylic acid, 2,4',5-trimethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.