5,6-Dibenzyloxy-3-methyl-benzofuran-2-carboxylic acid
TL;DR: 5,6-Dibenzyloxy-3-methyl-benzofuran-2-carboxylic acid (CAS 21452-86-8) is a chemical compound with molecular formula C24H20O5 and molecular weight 388.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-5,6-bis(phenylmethoxy)-1-benzofuran-2-carboxylic acid
Also Known As: 5,6-dibenzyloxy-3-methyl-benzofuran-2-carboxylic acid, 5,6-bis(benzyloxy)-3-methyl-1-benzofuran-2-carboxylic acid, 3-methyl-5,6-bis(phenylmethoxy)-1-benzofuran-2-carboxylic acid
| Molecular Formula | C24H20O5 |
|---|---|
| Molecular Weight | 388.13 g/mol |
| LogP | 5.59742 |
| Topological Polar Surface Area | 68.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 388.13107 |
| Heavy Atoms | 29 |
| Complexity | 1130.3748 |
Chemical Identifiers
| CAS Number | 21452-86-8 |
|---|---|
| SMILES | CC1=C(OC2=CC(=C(C=C12)OCC3=CC=CC=C3)OCC4=CC=CC=C4)C(=O)O |
Product Overview
5,6-Dibenzyloxy-3-methyl-benzofuran-2-carboxylic acid (CAS 21452-86-8), with molecular formula C24H20O5 and molecular weight 388.13 g/mol. IUPAC: 3-methyl-5,6-bis(phenylmethoxy)-1-benzofuran-2-carboxylic acid.
Chemical Property Profile of 5,6-Dibenzyloxy-3-methyl-benzofuran-2-carboxylic acid
Property Insights of 5,6-Dibenzyloxy-3-methyl-benzofuran-2-carboxylic acid
The XLogP value of 5.59742 indicates that 5,6-Dibenzyloxy-3-methyl-benzofuran-2-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,6-Dibenzyloxy-3-methyl-benzofuran-2-carboxylic acid. Following Lipinski's Rule of Five, 5,6-Dibenzyloxy-3-methyl-benzofuran-2-carboxylic acid has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5,6-Dibenzyloxy-3-methyl-benzofuran-2-carboxylic acid?
The CAS number of 5,6-Dibenzyloxy-3-methyl-benzofuran-2-carboxylic acid is 21452-86-8.
What is the molecular formula of 5,6-Dibenzyloxy-3-methyl-benzofuran-2-carboxylic acid?
The molecular formula of 5,6-Dibenzyloxy-3-methyl-benzofuran-2-carboxylic acid is C24H20O5.
What is the molecular weight of 5,6-Dibenzyloxy-3-methyl-benzofuran-2-carboxylic acid?
The molecular weight of 5,6-Dibenzyloxy-3-methyl-benzofuran-2-carboxylic acid is 388.13 g/mol.
Where can I buy 5,6-Dibenzyloxy-3-methyl-benzofuran-2-carboxylic acid?
You can request a quote for 5,6-Dibenzyloxy-3-methyl-benzofuran-2-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,6-Dibenzyloxy-3-methyl-benzofuran-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5,6-Dibenzyloxy-3-methyl-benzofuran-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.