1,2,4-Benzenetricarboxylic acid, ester with 1,2-ethanediol
TL;DR: 1,2,4-Benzenetricarboxylic acid, ester with 1,2-ethanediol (CAS 71342-70-6) is a chemical compound with molecular formula C11H12O8 and molecular weight 272.05322 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
benzene-1,2,4-tricarboxylic acid;ethane-1,2-diol
Also Known As: Ethylene glycol trimellitate, Ethylene glycol and trimellitic anhydride ester, benzene-1,2,4-tricarboxylic acid- ethane-1,2-diol(1:1), 1,2,4-Benzenetricarboxylic acid, ester with 1,2-ethanediol, Trimellitic anhydride, ethylene glycol reaction product
Application Areas
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C11H12O8 |
| Molecular Weight | 272.05322 g/mol |
| XLogP | -0.25 |
| Topological Polar Surface Area (TPSA) | 152.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 272.05322 Da |
| Heavy Atoms | 19 |
| Complexity | 303.0 |
| SMILES | C1=CC(=C(C=C1C(=O)O)C(=O)O)C(=O)O.C(CO)O |
| InChIKey | PPSWQKPMZQIJJZ-UHFFFAOYSA-N |
Chemical Property Profile of 1,2,4-Benzenetricarboxylic acid, ester with 1,2-ethanediol
Property Insights of 1,2,4-Benzenetricarboxylic acid, ester with 1,2-ethanediol
The XLogP value of -0.25 indicates that 1,2,4-Benzenetricarboxylic acid, ester with 1,2-ethanediol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 152.0 Ų indicates high polarity, suggesting 1,2,4-Benzenetricarboxylic acid, ester with 1,2-ethanediol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,2,4-Benzenetricarboxylic acid, ester with 1,2-ethanediol has 5 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1,2,4-Benzenetricarboxylic acid, ester with 1,2-ethanediol?
The CAS number of 1,2,4-Benzenetricarboxylic acid, ester with 1,2-ethanediol is 71342-70-6.
What is the molecular formula of 1,2,4-Benzenetricarboxylic acid, ester with 1,2-ethanediol?
The molecular formula of 1,2,4-Benzenetricarboxylic acid, ester with 1,2-ethanediol is C11H12O8.
What is the molecular weight of 1,2,4-Benzenetricarboxylic acid, ester with 1,2-ethanediol?
The molecular weight of 1,2,4-Benzenetricarboxylic acid, ester with 1,2-ethanediol is 272.05322 g/mol.
Where can I buy 1,2,4-Benzenetricarboxylic acid, ester with 1,2-ethanediol?
You can request a quote for 1,2,4-Benzenetricarboxylic acid, ester with 1,2-ethanediol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,2,4-Benzenetricarboxylic acid, ester with 1,2-ethanediol?
Yes, CoreyChem provides custom synthesis services for 1,2,4-Benzenetricarboxylic acid, ester with 1,2-ethanediol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.