1,2-Cyclohexanedicarboxylic acid, 1,2-bis(2-ethylhexyl) ester
TL;DR: 1,2-Cyclohexanedicarboxylic acid, 1,2-bis(2-ethylhexyl) ester (CAS 84-71-9) is a chemical compound with molecular formula C24H44O4 and molecular weight 396.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2-ethylhexyl) cyclohexane-1,2-dicarboxylate
Also Known As: Bis(2-ethylhexyl) cyclohexane-1,2-dicarboxylate, DEHCH, Di(2-ethylhexyl) cyclohexane, di(2-ethylhexyl) hexahydrophthalate, Diisooctyl 1,2-cyclohexanedicarboxylate
| Molecular Formula | C24H44O4 |
|---|---|
| Molecular Weight | 396.32 g/mol |
| LogP | 7.8 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 16 |
| Exact Mass | 396.32397 |
| Heavy Atoms | 28 |
| Complexity | 394.0 |
Chemical Identifiers
| CAS Number | 84-71-9 |
|---|---|
| SMILES | CCCCC(CC)COC(=O)C1CCCCC1C(=O)OCC(CC)CCCC |
| InChIKey | DIMOQAGSNHTROK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2-Cyclohexanedicarboxylic acid, 1,2-bis(2-ethylhexyl) ester (CAS 84-71-9), with molecular formula C24H44O4 and molecular weight 396.32 g/mol. IUPAC: bis(2-ethylhexyl) cyclohexane-1,2-dicarboxylate.
Chemical Property Profile of 1,2-Cyclohexanedicarboxylic acid, 1,2-bis(2-ethylhexyl) ester
Property Insights of 1,2-Cyclohexanedicarboxylic acid, 1,2-bis(2-ethylhexyl) ester
The XLogP value of 7.8 indicates that 1,2-Cyclohexanedicarboxylic acid, 1,2-bis(2-ethylhexyl) ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 1,2-Cyclohexanedicarboxylic acid, 1,2-bis(2-ethylhexyl) ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Cyclohexanedicarboxylic acid, 1,2-bis(2-ethylhexyl) ester has 0 hydrogen bond donor(s) and 4 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-Cyclohexanedicarboxylic acid, 1,2-bis(2-ethylhexyl) ester?
The CAS number of 1,2-Cyclohexanedicarboxylic acid, 1,2-bis(2-ethylhexyl) ester is 84-71-9.
What is the molecular formula of 1,2-Cyclohexanedicarboxylic acid, 1,2-bis(2-ethylhexyl) ester?
The molecular formula of 1,2-Cyclohexanedicarboxylic acid, 1,2-bis(2-ethylhexyl) ester is C24H44O4.
What is the molecular weight of 1,2-Cyclohexanedicarboxylic acid, 1,2-bis(2-ethylhexyl) ester?
The molecular weight of 1,2-Cyclohexanedicarboxylic acid, 1,2-bis(2-ethylhexyl) ester is 396.32 g/mol.
Where can I buy 1,2-Cyclohexanedicarboxylic acid, 1,2-bis(2-ethylhexyl) ester?
You can request a quote for 1,2-Cyclohexanedicarboxylic acid, 1,2-bis(2-ethylhexyl) ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Cyclohexanedicarboxylic acid, 1,2-bis(2-ethylhexyl) ester?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Cyclohexanedicarboxylic acid, 1,2-bis(2-ethylhexyl) ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.