癸二酸1,10-二壬酯
TL;DR: 癸二酸1,10-二壬酯 (CAS 4121-16-8) is a chemical compound with molecular formula C28H54O4 and molecular weight 454.40 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
癸二酸1,10-二壬酯
dinonyl decanedioate
Also Known As: Dinonyl sebacate, dinonyl decanedioate, Bis nonylsebacat, Decanedioic acid, dinonyl ester, dinonyldecanedioate
| Molecular Formula | C28H54O4 |
|---|---|
| Molecular Weight | 454.40 g/mol |
| LogP | 10.7 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 27 |
| Exact Mass | 454.40222 |
| Heavy Atoms | 32 |
| Complexity | 370.0 |
Chemical Identifiers
| CAS Number | 4121-16-8 |
|---|---|
| SMILES | CCCCCCCCCOC(=O)CCCCCCCCC(=O)OCCCCCCCCC |
| InChIKey | VNTXONBESJNLBI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
癸二酸1,10-二壬酯 (CAS 4121-16-8), with molecular formula C28H54O4 and molecular weight 454.40 g/mol. IUPAC: dinonyl decanedioate.
Chemical Property Profile of 癸二酸1,10-二壬酯
Property Insights of 癸二酸1,10-二壬酯
The XLogP value of 10.7 indicates that 癸二酸1,10-二壬酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 癸二酸1,10-二壬酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 癸二酸1,10-二壬酯 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 癸二酸1,10-二壬酯?
The CAS number of 癸二酸1,10-二壬酯 is 4121-16-8.
What is the molecular formula of 癸二酸1,10-二壬酯?
The molecular formula of 癸二酸1,10-二壬酯 is C28H54O4.
What is the molecular weight of 癸二酸1,10-二壬酯?
The molecular weight of 癸二酸1,10-二壬酯 is 454.40 g/mol.
Where can I buy 癸二酸1,10-二壬酯?
You can request a quote for 癸二酸1,10-二壬酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 癸二酸1,10-二壬酯?
Yes, KEHONG BIO provides custom synthesis services for 癸二酸1,10-二壬酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.