1,1-Bis(1-methylethoxy)propane
TL;DR: 1,1-Bis(1-methylethoxy)propane (CAS 4744-09-6) is a chemical compound with molecular formula C9H20O2 and molecular weight 160.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1-di(propan-2-yloxy)propane
Also Known As: 1,1-Bis(1-methylethoxy)propane, 1,1-bis(propan-2-yloxy)propane, PROPANAL DIISOPROPYL ACETAL, 1,1-di(propan-2-yloxy)propane, propionaldehyde diisopropyl acetal
| Molecular Formula | C9H20O2 |
|---|---|
| Molecular Weight | 160.15 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 160.14633 |
| Heavy Atoms | 11 |
| Complexity | 79.0 |
Chemical Identifiers
| CAS Number | 4744-09-6 |
|---|---|
| SMILES | CCC(OC(C)C)OC(C)C |
| InChIKey | OMKOEKNZLXINHM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,1-Bis(1-methylethoxy)propane (CAS 4744-09-6), with molecular formula C9H20O2 and molecular weight 160.15 g/mol. IUPAC: 1,1-di(propan-2-yloxy)propane.
Chemical Property Profile of 1,1-Bis(1-methylethoxy)propane
Property Insights of 1,1-Bis(1-methylethoxy)propane
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1-Bis(1-methylethoxy)propane. With a topological polar surface area (TPSA) of 18.5 Ų, 1,1-Bis(1-methylethoxy)propane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1-Bis(1-methylethoxy)propane has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,1-Bis(1-methylethoxy)propane?
The CAS number of 1,1-Bis(1-methylethoxy)propane is 4744-09-6.
What is the molecular formula of 1,1-Bis(1-methylethoxy)propane?
The molecular formula of 1,1-Bis(1-methylethoxy)propane is C9H20O2.
What is the molecular weight of 1,1-Bis(1-methylethoxy)propane?
The molecular weight of 1,1-Bis(1-methylethoxy)propane is 160.15 g/mol.
Where can I buy 1,1-Bis(1-methylethoxy)propane?
You can request a quote for 1,1-Bis(1-methylethoxy)propane 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(1-methylethoxy)propane?
Yes, KEHONG BIO provides custom synthesis services for 1,1-Bis(1-methylethoxy)propane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.