1-(2,2-Diethoxyethoxy)-4-(1,1-dimethylpropyl)benzene
TL;DR: 1-(2,2-Diethoxyethoxy)-4-(1,1-dimethylpropyl)benzene (CAS 94159-33-8) is a chemical compound with molecular formula C17H28O3 and molecular weight 280.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,2-diethoxyethoxy)-4-(2-methylbutan-2-yl)benzene
Also Known As: EINECS 303-211-9, 1-(2,2-Diethoxyethoxy)-4-(1,1-dimethylpropyl)benzene, 1-(2,2-diethoxyethoxy)-4-(2-methylbutan-2-yl)benzene, BENZENE, 1-(2,2-DIETHOXYETHOXY)-4-(1,1-DIMETHYLPROPYL)-, 303-211-9
| Molecular Formula | C17H28O3 |
|---|---|
| Molecular Weight | 280.20 g/mol |
| LogP | 4.1521 |
| Topological Polar Surface Area | 27.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 280.20386 |
| Heavy Atoms | 20 |
| Complexity | 364.32645 |
Chemical Identifiers
| CAS Number | 94159-33-8 |
|---|---|
| SMILES | CCC(C)(C)C1=CC=C(C=C1)OCC(OCC)OCC |
Product Overview
1-(2,2-Diethoxyethoxy)-4-(1,1-dimethylpropyl)benzene (CAS 94159-33-8), with molecular formula C17H28O3 and molecular weight 280.20 g/mol. IUPAC: 1-(2,2-diethoxyethoxy)-4-(2-methylbutan-2-yl)benzene.
Chemical Property Profile of 1-(2,2-Diethoxyethoxy)-4-(1,1-dimethylpropyl)benzene
Property Insights of 1-(2,2-Diethoxyethoxy)-4-(1,1-dimethylpropyl)benzene
The XLogP value of 4.1521 indicates that 1-(2,2-Diethoxyethoxy)-4-(1,1-dimethylpropyl)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.69 Ų, 1-(2,2-Diethoxyethoxy)-4-(1,1-dimethylpropyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2,2-Diethoxyethoxy)-4-(1,1-dimethylpropyl)benzene has 0 hydrogen bond donor(s) and 3 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-(2,2-Diethoxyethoxy)-4-(1,1-dimethylpropyl)benzene?
The CAS number of 1-(2,2-Diethoxyethoxy)-4-(1,1-dimethylpropyl)benzene is 94159-33-8.
What is the molecular formula of 1-(2,2-Diethoxyethoxy)-4-(1,1-dimethylpropyl)benzene?
The molecular formula of 1-(2,2-Diethoxyethoxy)-4-(1,1-dimethylpropyl)benzene is C17H28O3.
What is the molecular weight of 1-(2,2-Diethoxyethoxy)-4-(1,1-dimethylpropyl)benzene?
The molecular weight of 1-(2,2-Diethoxyethoxy)-4-(1,1-dimethylpropyl)benzene is 280.20 g/mol.
Where can I buy 1-(2,2-Diethoxyethoxy)-4-(1,1-dimethylpropyl)benzene?
You can request a quote for 1-(2,2-Diethoxyethoxy)-4-(1,1-dimethylpropyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2,2-Diethoxyethoxy)-4-(1,1-dimethylpropyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,2-Diethoxyethoxy)-4-(1,1-dimethylpropyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.