Di-n-hexadecyl sebacate
TL;DR: Di-n-hexadecyl sebacate (CAS 26719-48-2) is a chemical compound with molecular formula C42H82O4 and molecular weight 650.62 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dihexadecyl decanedioate
Also Known As: Di-n-hexadecyl sebacate, dihexadecyl decanedioate, Sebacic acid dihexadecyl ester, decanedioic acid dihexadecyl ester, 1,10-DIHEXADECYL DECANEDIOATE
| Molecular Formula | C42H82O4 |
|---|---|
| Molecular Weight | 650.62 g/mol |
| LogP | 18.3 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 41 |
| Exact Mass | 650.62134 |
| Heavy Atoms | 46 |
| Complexity | 552.0 |
Chemical Identifiers
| CAS Number | 26719-48-2 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCOC(=O)CCCCCCCCC(=O)OCCCCCCCCCCCCCCCC |
| InChIKey | QTDJUGJAGNDLKQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Di-n-hexadecyl sebacate (CAS 26719-48-2), with molecular formula C42H82O4 and molecular weight 650.62 g/mol. IUPAC: dihexadecyl decanedioate.
Chemical Property Profile of Di-n-hexadecyl sebacate
Property Insights of Di-n-hexadecyl sebacate
The XLogP value of 18.3 indicates that Di-n-hexadecyl 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, Di-n-hexadecyl sebacate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Di-n-hexadecyl 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 Di-n-hexadecyl sebacate?
The CAS number of Di-n-hexadecyl sebacate is 26719-48-2.
What is the molecular formula of Di-n-hexadecyl sebacate?
The molecular formula of Di-n-hexadecyl sebacate is C42H82O4.
What is the molecular weight of Di-n-hexadecyl sebacate?
The molecular weight of Di-n-hexadecyl sebacate is 650.62 g/mol.
Where can I buy Di-n-hexadecyl sebacate?
You can request a quote for Di-n-hexadecyl sebacate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Di-n-hexadecyl sebacate?
Yes, KEHONG BIO provides custom synthesis services for Di-n-hexadecyl sebacate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.