1,1-Bis(3-methylbutoxy)hexadecane
TL;DR: 1,1-Bis(3-methylbutoxy)hexadecane (CAS 18302-71-1) is a chemical compound with molecular formula C26H54O2 and molecular weight 398.41 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1-bis(3-methylbutoxy)hexadecane
Also Known As: Hexadecanal diisopentyl acetal, 1,1-bis(3-methylbutoxy)hexadecane, Palmitaldehyde diisopentyl acetal, Palmitaldehyde, diisopentyl acetal, 1,1-Bis(isopentyloxy)hexadecane #
| Molecular Formula | C26H54O2 |
|---|---|
| Molecular Weight | 398.41 g/mol |
| LogP | 11.2 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 22 |
| Exact Mass | 398.41238 |
| Heavy Atoms | 28 |
| Complexity | 274.0 |
Chemical Identifiers
| CAS Number | 18302-71-1 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(OCCC(C)C)OCCC(C)C |
| InChIKey | KBPNNHFVJQEULH-UHFFFAOYSA-N |
Product Overview
1,1-Bis(3-methylbutoxy)hexadecane (CAS 18302-71-1), with molecular formula C26H54O2 and molecular weight 398.41 g/mol. IUPAC: 1,1-bis(3-methylbutoxy)hexadecane.
Chemical Property Profile of 1,1-Bis(3-methylbutoxy)hexadecane
Property Insights of 1,1-Bis(3-methylbutoxy)hexadecane
The XLogP value of 11.2 indicates that 1,1-Bis(3-methylbutoxy)hexadecane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, 1,1-Bis(3-methylbutoxy)hexadecane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1-Bis(3-methylbutoxy)hexadecane 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 1,1-Bis(3-methylbutoxy)hexadecane?
The CAS number of 1,1-Bis(3-methylbutoxy)hexadecane is 18302-71-1.
What is the molecular formula of 1,1-Bis(3-methylbutoxy)hexadecane?
The molecular formula of 1,1-Bis(3-methylbutoxy)hexadecane is C26H54O2.
What is the molecular weight of 1,1-Bis(3-methylbutoxy)hexadecane?
The molecular weight of 1,1-Bis(3-methylbutoxy)hexadecane is 398.41 g/mol.
Where can I buy 1,1-Bis(3-methylbutoxy)hexadecane?
You can request a quote for 1,1-Bis(3-methylbutoxy)hexadecane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1-Bis(3-methylbutoxy)hexadecane?
Yes, KEHONG BIO provides custom synthesis services for 1,1-Bis(3-methylbutoxy)hexadecane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.