![4,4'-[Oxybis(methylene)]di(benzene-1,2-dicarboxylic acid) structure](/static/products/852/85294-36-6.png)
4,4'-[Oxybis(methylene)]di(benzene-1,2-dicarboxylic acid)
TL;DR: 4,4'-[Oxybis(methylene)]di(benzene-1,2-dicarboxylic acid) (CAS 85294-36-6) is a chemical compound with molecular formula C18H14O9 and molecular weight 374.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3,4-dicarboxyphenyl)methoxymethyl]phthalic acid
Also Known As: 4-[(3,4-dicarboxyphenyl)methoxymethyl]phthalic acid, 4,4'-[Oxybis(methylene)]di(benzene-1,2-dicarboxylic acid), 1,2-Benzenedicarboxylic acid, 4,4'-(hydroxymethylene)bis-, ar,ar'-dimethyl ester
| Molecular Formula | C18H14O9 |
|---|---|
| Molecular Weight | 374.06 g/mol |
| LogP | 2.1962 |
| Topological Polar Surface Area | 158.43 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 374.06378 |
| Heavy Atoms | 27 |
| Complexity | 854.9247 |
Chemical Identifiers
| CAS Number | 85294-36-6 |
|---|---|
| SMILES | C1=CC(=C(C=C1COCC2=CC(=C(C=C2)C(=O)O)C(=O)O)C(=O)O)C(=O)O |
Product Overview
4,4'-[Oxybis(methylene)]di(benzene-1,2-dicarboxylic acid) (CAS 85294-36-6), with molecular formula C18H14O9 and molecular weight 374.06 g/mol. IUPAC: 4-[(3,4-dicarboxyphenyl)methoxymethyl]phthalic acid.
Chemical Property Profile of 4,4'-[Oxybis(methylene)]di(benzene-1,2-dicarboxylic acid)
Property Insights of 4,4'-[Oxybis(methylene)]di(benzene-1,2-dicarboxylic acid)
The XLogP value of 2.1962 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,4'-[Oxybis(methylene)]di(benzene-1,2-dicarboxylic acid). The TPSA of 158.43 Ų indicates high polarity, suggesting 4,4'-[Oxybis(methylene)]di(benzene-1,2-dicarboxylic acid) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4,4'-[Oxybis(methylene)]di(benzene-1,2-dicarboxylic acid) has 4 hydrogen bond donor(s) and 5 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 4,4'-[Oxybis(methylene)]di(benzene-1,2-dicarboxylic acid)?
The CAS number of 4,4'-[Oxybis(methylene)]di(benzene-1,2-dicarboxylic acid) is 85294-36-6.
What is the molecular formula of 4,4'-[Oxybis(methylene)]di(benzene-1,2-dicarboxylic acid)?
The molecular formula of 4,4'-[Oxybis(methylene)]di(benzene-1,2-dicarboxylic acid) is C18H14O9.
What is the molecular weight of 4,4'-[Oxybis(methylene)]di(benzene-1,2-dicarboxylic acid)?
The molecular weight of 4,4'-[Oxybis(methylene)]di(benzene-1,2-dicarboxylic acid) is 374.06 g/mol.
Where can I buy 4,4'-[Oxybis(methylene)]di(benzene-1,2-dicarboxylic acid)?
You can request a quote for 4,4'-[Oxybis(methylene)]di(benzene-1,2-dicarboxylic acid) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4'-[Oxybis(methylene)]di(benzene-1,2-dicarboxylic acid)?
Yes, KEHONG BIO provides custom synthesis services for 4,4'-[Oxybis(methylene)]di(benzene-1,2-dicarboxylic acid) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.