Isodecyl Palmitate
TL;DR: Isodecyl Palmitate (CAS 59231-33-3) is a chemical compound with molecular formula C26H52O2 and molecular weight 396.40 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-methylnonyl hexadecanoate
Also Known As: Isodecyl palmitate, 8-methylnonyl hexadecanoate, Hexadecanoic acid, isodecyl ester, ISODECYL PALMITATE [INCI], 4,6-dimethyl-2-[(4-nitrobenzyl)sulfanyl]quinazoline
| Molecular Formula | C26H52O2 |
|---|---|
| Molecular Weight | 396.40 g/mol |
| LogP | 11.7 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 23 |
| Exact Mass | 396.39673 |
| Heavy Atoms | 28 |
| Complexity | 312.0 |
Chemical Identifiers
| CAS Number | 59231-33-3 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)OCCCCCCCC(C)C |
| InChIKey | KUCCCVXLSQTKHH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Isodecyl Palmitate (CAS 59231-33-3), with molecular formula C26H52O2 and molecular weight 396.40 g/mol. IUPAC: 8-methylnonyl hexadecanoate.
Chemical Property Profile of Isodecyl Palmitate
Property Insights of Isodecyl Palmitate
The XLogP value of 11.7 indicates that Isodecyl Palmitate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Isodecyl Palmitate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isodecyl Palmitate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Isodecyl Palmitate?
The CAS number of Isodecyl Palmitate is 59231-33-3.
What is the molecular formula of Isodecyl Palmitate?
The molecular formula of Isodecyl Palmitate is C26H52O2.
What is the molecular weight of Isodecyl Palmitate?
The molecular weight of Isodecyl Palmitate is 396.40 g/mol.
Where can I buy Isodecyl Palmitate?
You can request a quote for Isodecyl Palmitate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isodecyl Palmitate?
Yes, KEHONG BIO provides custom synthesis services for Isodecyl Palmitate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.