Distearyl sebacate
TL;DR: Distearyl sebacate (CAS 3072-03-5) is a chemical compound with molecular formula C46H90O4 and molecular weight 706.68 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dioctadecyl decanedioate
Also Known As: distearyl sebacate, Di-n-octadecyl sebacate, dioctadecyl sebacate, dioctadecyl decanedioate, Sebacic acid dioctadecyl ester
| Molecular Formula | C46H90O4 |
|---|---|
| Molecular Weight | 706.68 g/mol |
| LogP | 20.4 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 45 |
| Exact Mass | 706.6839 |
| Heavy Atoms | 50 |
| Complexity | 607.0 |
Chemical Identifiers
| CAS Number | 3072-03-5 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCCC(=O)OCCCCCCCCCCCCCCCCCC |
| InChIKey | NTUPDNAURMTJID-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Distearyl sebacate (CAS 3072-03-5), with molecular formula C46H90O4 and molecular weight 706.68 g/mol. IUPAC: dioctadecyl decanedioate.
Chemical Property Profile of Distearyl sebacate
Property Insights of Distearyl sebacate
The XLogP value of 20.4 indicates that Distearyl sebacate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Distearyl sebacate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Distearyl sebacate 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 Distearyl sebacate?
The CAS number of Distearyl sebacate is 3072-03-5.
What is the molecular formula of Distearyl sebacate?
The molecular formula of Distearyl sebacate is C46H90O4.
What is the molecular weight of Distearyl sebacate?
The molecular weight of Distearyl sebacate is 706.68 g/mol.
Where can I buy Distearyl sebacate?
You can request a quote for Distearyl sebacate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Distearyl sebacate?
Yes, KEHONG BIO provides custom synthesis services for Distearyl sebacate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.