1,2-Benzenedicarboxylic acid, mixed esters with 3-(1,2-dihydroxyethoxy)-1,2-propanediol and stearic acid
TL;DR: 1,2-Benzenedicarboxylic acid, mixed esters with 3-(1,2-dihydroxyethoxy)-1,2-propanediol and stearic acid (CAS 73049-89-5) is a chemical compound with molecular formula C31H52O8 and molecular weight 552.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-O-[(2R)-3-(1,1-dihydroxyethoxy)-2-hydroxypropyl] 1-O-octadecyl benzene-1,2-dicarboxylate
Also Known As: 1,2-Benzenedicarboxylic acid, mixed esters with 3-(1,2-dihydroxyethoxy)-1,2-propanediol and stearic acid, Octadecyl [(2R)-3-(1,1-dihydroxyethoxy)-2-hydroxy-propyl] Benzene-1,2-dicarboxylate, 2-O-[(2R)-3-(1,1-dihydroxyethoxy)-2-hydroxypropyl] 1-O-octadecyl benzene-1,2-dicarboxylate
| Molecular Formula | C31H52O8 |
|---|---|
| Molecular Weight | 552.37 g/mol |
| LogP | 6.2975 |
| Topological Polar Surface Area | 122.52 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 24 |
| Exact Mass | 552.3662 |
| Heavy Atoms | 39 |
| Complexity | 774.0976 |
Chemical Identifiers
| CAS Number | 73049-89-5 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OC[C@@H](COC(C)(O)O)O |
Product Overview
1,2-Benzenedicarboxylic acid, mixed esters with 3-(1,2-dihydroxyethoxy)-1,2-propanediol and stearic acid (CAS 73049-89-5), with molecular formula C31H52O8 and molecular weight 552.37 g/mol. IUPAC: 2-O-[(2R)-3-(1,1-dihydroxyethoxy)-2-hydroxypropyl] 1-O-octadecyl benzene-1,2-dicarboxylate.
Chemical Property Profile of 1,2-Benzenedicarboxylic acid, mixed esters with 3-(1,2-dihydroxyethoxy)-1,2-propanediol and stearic acid
Property Insights of 1,2-Benzenedicarboxylic acid, mixed esters with 3-(1,2-dihydroxyethoxy)-1,2-propanediol and stearic acid
The XLogP value of 6.2975 indicates that 1,2-Benzenedicarboxylic acid, mixed esters with 3-(1,2-dihydroxyethoxy)-1,2-propanediol and stearic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 122.52 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2-Benzenedicarboxylic acid, mixed esters with 3-(1,2-dihydroxyethoxy)-1,2-propanediol and stearic acid. Following Lipinski's Rule of Five, 1,2-Benzenedicarboxylic acid, mixed esters with 3-(1,2-dihydroxyethoxy)-1,2-propanediol and stearic acid has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,2-Benzenedicarboxylic acid, mixed esters with 3-(1,2-dihydroxyethoxy)-1,2-propanediol and stearic acid?
The CAS number of 1,2-Benzenedicarboxylic acid, mixed esters with 3-(1,2-dihydroxyethoxy)-1,2-propanediol and stearic acid is 73049-89-5.
What is the molecular formula of 1,2-Benzenedicarboxylic acid, mixed esters with 3-(1,2-dihydroxyethoxy)-1,2-propanediol and stearic acid?
The molecular formula of 1,2-Benzenedicarboxylic acid, mixed esters with 3-(1,2-dihydroxyethoxy)-1,2-propanediol and stearic acid is C31H52O8.
What is the molecular weight of 1,2-Benzenedicarboxylic acid, mixed esters with 3-(1,2-dihydroxyethoxy)-1,2-propanediol and stearic acid?
The molecular weight of 1,2-Benzenedicarboxylic acid, mixed esters with 3-(1,2-dihydroxyethoxy)-1,2-propanediol and stearic acid is 552.37 g/mol.
Where can I buy 1,2-Benzenedicarboxylic acid, mixed esters with 3-(1,2-dihydroxyethoxy)-1,2-propanediol and stearic acid?
You can request a quote for 1,2-Benzenedicarboxylic acid, mixed esters with 3-(1,2-dihydroxyethoxy)-1,2-propanediol and stearic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Benzenedicarboxylic acid, mixed esters with 3-(1,2-dihydroxyethoxy)-1,2-propanediol and stearic acid?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Benzenedicarboxylic acid, mixed esters with 3-(1,2-dihydroxyethoxy)-1,2-propanediol and stearic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.