Benzene-1,3-dicarboxylic acid--2,2'-oxydi(ethan-1-ol) (1/1)
TL;DR: Benzene-1,3-dicarboxylic acid--2,2'-oxydi(ethan-1-ol) (1/1) (CAS 60135-93-5) is a chemical compound with molecular formula C12H16O7 and molecular weight 272.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzene-1,3-dicarboxylic acid;2-(2-hydroxyethoxy)ethanol
Also Known As: (C8-H6-O4.C4-H10-O3)x-, 2,2'-Dihydroxydiethyl ether, m-phthalic acid polymer, benzene-1,3-dicarboxylic acid; 2-(2-hydroxyethoxy)ethanol, 1,3-Benzenedicarboxylic acid, polymer with 2,2'-oxybis[ethanol], 1,3-Benzenedicarboxylic acid, polymer with 2,2'-oxybis(ethanol)
| Molecular Formula | C12H16O7 |
|---|---|
| Molecular Weight | 272.09 g/mol |
| LogP | 0.0706 |
| Topological Polar Surface Area | 124.29 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 272.0896 |
| Heavy Atoms | 19 |
| Complexity | 369.5693 |
Chemical Identifiers
| CAS Number | 60135-93-5 |
|---|---|
| SMILES | C1=CC(=CC(=C1)C(=O)O)C(=O)O.C(COCCO)O |
Product Overview
Benzene-1,3-dicarboxylic acid--2,2'-oxydi(ethan-1-ol) (1/1) (CAS 60135-93-5), with molecular formula C12H16O7 and molecular weight 272.09 g/mol. IUPAC: benzene-1,3-dicarboxylic acid;2-(2-hydroxyethoxy)ethanol.
Chemical Property Profile of Benzene-1,3-dicarboxylic acid--2,2'-oxydi(ethan-1-ol) (1/1)
Property Insights of Benzene-1,3-dicarboxylic acid--2,2'-oxydi(ethan-1-ol) (1/1)
The XLogP value of 0.0706 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzene-1,3-dicarboxylic acid--2,2'-oxydi(ethan-1-ol) (1/1). The TPSA of 124.29 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzene-1,3-dicarboxylic acid--2,2'-oxydi(ethan-1-ol) (1/1). Following Lipinski's Rule of Five, Benzene-1,3-dicarboxylic acid--2,2'-oxydi(ethan-1-ol) (1/1) 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 Benzene-1,3-dicarboxylic acid--2,2'-oxydi(ethan-1-ol) (1/1)?
The CAS number of Benzene-1,3-dicarboxylic acid--2,2'-oxydi(ethan-1-ol) (1/1) is 60135-93-5.
What is the molecular formula of Benzene-1,3-dicarboxylic acid--2,2'-oxydi(ethan-1-ol) (1/1)?
The molecular formula of Benzene-1,3-dicarboxylic acid--2,2'-oxydi(ethan-1-ol) (1/1) is C12H16O7.
What is the molecular weight of Benzene-1,3-dicarboxylic acid--2,2'-oxydi(ethan-1-ol) (1/1)?
The molecular weight of Benzene-1,3-dicarboxylic acid--2,2'-oxydi(ethan-1-ol) (1/1) is 272.09 g/mol.
Where can I buy Benzene-1,3-dicarboxylic acid--2,2'-oxydi(ethan-1-ol) (1/1)?
You can request a quote for Benzene-1,3-dicarboxylic acid--2,2'-oxydi(ethan-1-ol) (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene-1,3-dicarboxylic acid--2,2'-oxydi(ethan-1-ol) (1/1)?
Yes, KEHONG BIO provides custom synthesis services for Benzene-1,3-dicarboxylic acid--2,2'-oxydi(ethan-1-ol) (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.