1,3-Benzenedicarboxylic acid, mixed esters with glycerol and linoleic acid
TL;DR: 1,3-Benzenedicarboxylic acid, mixed esters with glycerol and linoleic acid (CAS 68953-86-6) is a chemical compound with molecular formula C29H46O9 and molecular weight 538.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzene-1,3-dicarboxylic acid;(9Z,12Z)-octadeca-9,12-dienoic acid;propane-1,2,3-triol
Also Known As: 1,3-Benzenedicarboxylic acid, mixed esters with glycerol and linoleic acid, benzene-1,3-dicarboxylic acid; (9Z,12Z)-octadeca-9,12-dienoic acid; propane-1,2,3-triol
| Molecular Formula | C29H46O9 |
|---|---|
| Molecular Weight | 538.31 g/mol |
| LogP | 5.2994 |
| Topological Polar Surface Area | 172.59 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 18 |
| Exact Mass | 538.3142 |
| Heavy Atoms | 38 |
| Complexity | 769.74347 |
Chemical Identifiers
| CAS Number | 68953-86-6 |
|---|---|
| SMILES | CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C(C(CO)O)O |
Product Overview
1,3-Benzenedicarboxylic acid, mixed esters with glycerol and linoleic acid (CAS 68953-86-6), with molecular formula C29H46O9 and molecular weight 538.31 g/mol. IUPAC: benzene-1,3-dicarboxylic acid;(9Z,12Z)-octadeca-9,12-dienoic acid;propane-1,2,3-triol.
Chemical Property Profile of 1,3-Benzenedicarboxylic acid, mixed esters with glycerol and linoleic acid
Property Insights of 1,3-Benzenedicarboxylic acid, mixed esters with glycerol and linoleic acid
The XLogP value of 5.2994 indicates that 1,3-Benzenedicarboxylic acid, mixed esters with glycerol and linoleic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 172.59 Ų indicates high polarity, suggesting 1,3-Benzenedicarboxylic acid, mixed esters with glycerol and linoleic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,3-Benzenedicarboxylic acid, mixed esters with glycerol and linoleic acid has 6 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,3-Benzenedicarboxylic acid, mixed esters with glycerol and linoleic acid?
The CAS number of 1,3-Benzenedicarboxylic acid, mixed esters with glycerol and linoleic acid is 68953-86-6.
What is the molecular formula of 1,3-Benzenedicarboxylic acid, mixed esters with glycerol and linoleic acid?
The molecular formula of 1,3-Benzenedicarboxylic acid, mixed esters with glycerol and linoleic acid is C29H46O9.
What is the molecular weight of 1,3-Benzenedicarboxylic acid, mixed esters with glycerol and linoleic acid?
The molecular weight of 1,3-Benzenedicarboxylic acid, mixed esters with glycerol and linoleic acid is 538.31 g/mol.
Where can I buy 1,3-Benzenedicarboxylic acid, mixed esters with glycerol and linoleic acid?
You can request a quote for 1,3-Benzenedicarboxylic acid, mixed esters with glycerol and linoleic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Benzenedicarboxylic acid, mixed esters with glycerol and linoleic acid?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Benzenedicarboxylic acid, mixed esters with glycerol and linoleic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.