Isopropyl Behenate
TL;DR: Isopropyl Behenate (CAS 26718-95-6) is a chemical compound with molecular formula C25H50O2 and molecular weight 382.38 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl docosanoate
Also Known As: Isopropyl behenate, Isopropyl docosanoate, Docosanoic acid, isopropyl ester, propan-2-yl docosanoate, isopropyldocosanoate
| Molecular Formula | C25H50O2 |
|---|---|
| Molecular Weight | 382.38 g/mol |
| LogP | 8.7599 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 21 |
| Exact Mass | 382.38107 |
| Heavy Atoms | 27 |
| Complexity | 298.699 |
Chemical Identifiers
| CAS Number | 26718-95-6 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCCCCCC(=O)OC(C)C |
Product Overview
Isopropyl Behenate (CAS 26718-95-6), with molecular formula C25H50O2 and molecular weight 382.38 g/mol. IUPAC: propan-2-yl docosanoate.
Chemical Property Profile of Isopropyl Behenate
Property Insights of Isopropyl Behenate
The XLogP value of 8.7599 indicates that Isopropyl Behenate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Isopropyl Behenate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isopropyl Behenate 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 Isopropyl Behenate?
The CAS number of Isopropyl Behenate is 26718-95-6.
What is the molecular formula of Isopropyl Behenate?
The molecular formula of Isopropyl Behenate is C25H50O2.
What is the molecular weight of Isopropyl Behenate?
The molecular weight of Isopropyl Behenate is 382.38 g/mol.
Where can I buy Isopropyl Behenate?
You can request a quote for Isopropyl Behenate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isopropyl Behenate?
Yes, KEHONG BIO provides custom synthesis services for Isopropyl Behenate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.