1,1-Diethoxydodecane
TL;DR: 1,1-Diethoxydodecane (CAS 53405-98-4) is a chemical compound with molecular formula C16H34O2 and molecular weight 258.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1-diethoxydodecane
Also Known As: 1,1-Diethoxydodecane, Dodecanal diethyl acetal, Dodecane, 1,1-diethoxy-, 1,1-Diethoxidedecane, 258-541-5
| Molecular Formula | C16H34O2 |
|---|---|
| Molecular Weight | 258.26 g/mol |
| LogP | 6.4 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 14 |
| Exact Mass | 258.2559 |
| Heavy Atoms | 18 |
| Complexity | 142.0 |
Chemical Identifiers
| CAS Number | 53405-98-4 |
|---|---|
| SMILES | CCCCCCCCCCCC(OCC)OCC |
| InChIKey | CHURJRSXCYIYQX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,1-Diethoxydodecane (CAS 53405-98-4), with molecular formula C16H34O2 and molecular weight 258.26 g/mol. IUPAC: 1,1-diethoxydodecane.
Chemical Property Profile of 1,1-Diethoxydodecane
Property Insights of 1,1-Diethoxydodecane
The XLogP value of 6.4 indicates that 1,1-Diethoxydodecane 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-Diethoxydodecane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1-Diethoxydodecane 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-Diethoxydodecane?
The CAS number of 1,1-Diethoxydodecane is 53405-98-4.
What is the molecular formula of 1,1-Diethoxydodecane?
The molecular formula of 1,1-Diethoxydodecane is C16H34O2.
What is the molecular weight of 1,1-Diethoxydodecane?
The molecular weight of 1,1-Diethoxydodecane is 258.26 g/mol.
Where can I buy 1,1-Diethoxydodecane?
You can request a quote for 1,1-Diethoxydodecane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1-Diethoxydodecane?
Yes, KEHONG BIO provides custom synthesis services for 1,1-Diethoxydodecane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.