Glycerol trimellitate
TL;DR: Glycerol trimellitate (CAS 71243-42-0) is a chemical compound with molecular formula C12H14O9 and molecular weight 302.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzene-1,2,4-tricarboxylic acid;propane-1,2,3-triol
Also Known As: Glycerine trimellitate, Glycerol trimellitate, Glyceryl trimellitate, Trimellitic anhydride, glycerine adduct, 1,2,4-Benzenetricarboxylic acid, ester with 1,2,3-propanetriol
| Molecular Formula | C12H14O9 |
|---|---|
| Molecular Weight | 302.06 g/mol |
| LogP | -0.89 |
| Topological Polar Surface Area | 173.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 302.06378 |
| Heavy Atoms | 21 |
| Complexity | 322.0 |
Chemical Identifiers
| CAS Number | 71243-42-0 |
|---|---|
| SMILES | C1=CC(=C(C=C1C(=O)O)C(=O)O)C(=O)O.C(C(CO)O)O |
| InChIKey | QNMNPDQTYTUETP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Glycerol trimellitate (CAS 71243-42-0), with molecular formula C12H14O9 and molecular weight 302.06 g/mol. IUPAC: benzene-1,2,4-tricarboxylic acid;propane-1,2,3-triol.
Chemical Property Profile of Glycerol trimellitate
Property Insights of Glycerol trimellitate
The XLogP value of -0.89 indicates that Glycerol trimellitate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 173.0 Ų indicates high polarity, suggesting Glycerol trimellitate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Glycerol trimellitate has 6 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Glycerol trimellitate?
The CAS number of Glycerol trimellitate is 71243-42-0.
What is the molecular formula of Glycerol trimellitate?
The molecular formula of Glycerol trimellitate is C12H14O9.
What is the molecular weight of Glycerol trimellitate?
The molecular weight of Glycerol trimellitate is 302.06 g/mol.
Where can I buy Glycerol trimellitate?
You can request a quote for Glycerol trimellitate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Glycerol trimellitate?
Yes, KEHONG BIO provides custom synthesis services for Glycerol trimellitate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.