2,2-Bis(4-ethoxyphenyl)-3,3-dimethyloxetane
TL;DR: 2,2-Bis(4-ethoxyphenyl)-3,3-dimethyloxetane (CAS 5461-98-3) is a chemical compound with molecular formula C21H26O3 and molecular weight 326.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-bis(4-ethoxyphenyl)-3,3-dimethyloxetane
Also Known As: EDO (pesticide), 2,2-Bis(4-ethoxyphenyl)-3,3-dimethyloxetane, 2,2-Bis -3,3-dimethyloxetane, 2,2-bis(p-ethoxyphenyl)-3,3-dimethyloxetane, Oxetane, 2,2-bis(4-ethoxyphenyl)-3,3-dimethyl-
| Molecular Formula | C21H26O3 |
|---|---|
| Molecular Weight | 326.19 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 326.1882 |
| Heavy Atoms | 24 |
| Complexity | 364.0 |
Chemical Identifiers
| CAS Number | 5461-98-3 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)C2(C(CO2)(C)C)C3=CC=C(C=C3)OCC |
| InChIKey | TZKHODQGBZHQRH-UHFFFAOYSA-N |
Product Overview
2,2-Bis(4-ethoxyphenyl)-3,3-dimethyloxetane (CAS 5461-98-3), with molecular formula C21H26O3 and molecular weight 326.19 g/mol. IUPAC: 2,2-bis(4-ethoxyphenyl)-3,3-dimethyloxetane.
Chemical Property Profile of 2,2-Bis(4-ethoxyphenyl)-3,3-dimethyloxetane
Property Insights of 2,2-Bis(4-ethoxyphenyl)-3,3-dimethyloxetane
The XLogP value of 4.7 indicates that 2,2-Bis(4-ethoxyphenyl)-3,3-dimethyloxetane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.7 Ų, 2,2-Bis(4-ethoxyphenyl)-3,3-dimethyloxetane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2-Bis(4-ethoxyphenyl)-3,3-dimethyloxetane 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 2,2-Bis(4-ethoxyphenyl)-3,3-dimethyloxetane?
The CAS number of 2,2-Bis(4-ethoxyphenyl)-3,3-dimethyloxetane is 5461-98-3.
What is the molecular formula of 2,2-Bis(4-ethoxyphenyl)-3,3-dimethyloxetane?
The molecular formula of 2,2-Bis(4-ethoxyphenyl)-3,3-dimethyloxetane is C21H26O3.
What is the molecular weight of 2,2-Bis(4-ethoxyphenyl)-3,3-dimethyloxetane?
The molecular weight of 2,2-Bis(4-ethoxyphenyl)-3,3-dimethyloxetane is 326.19 g/mol.
Where can I buy 2,2-Bis(4-ethoxyphenyl)-3,3-dimethyloxetane?
You can request a quote for 2,2-Bis(4-ethoxyphenyl)-3,3-dimethyloxetane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-Bis(4-ethoxyphenyl)-3,3-dimethyloxetane?
Yes, KEHONG BIO provides custom synthesis services for 2,2-Bis(4-ethoxyphenyl)-3,3-dimethyloxetane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.