cis-2-Ethyl-5-methyl-5-(2-methylbenzyloxy)-1,3-dioxane
TL;DR: cis-2-Ethyl-5-methyl-5-(2-methylbenzyloxy)-1,3-dioxane (CAS 66384-52-9) is a chemical compound with molecular formula C15H22O3 and molecular weight 250.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethyl-5-methyl-5-[(2-methylphenyl)methoxy]-1,3-dioxane
Also Known As: Fmc 25213, cis-2-Ethyl-5-methyl-5-(2-methylbenzyloxy)-1,3-dioxane, 2-ethyl-5-methyl-5-[(2-methylphenyl)methoxy]-1,3-dioxane, 2-Ethyl-5-methyl-c-5-(2-methylbenzyloxy)-1,3-dioxane, 2-ethyl-5-methyl-5-[(2-methylbenzyl)oxy]-1,3-dioxane
| Molecular Formula | C15H22O3 |
|---|---|
| Molecular Weight | 250.16 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 250.15689 |
| Heavy Atoms | 18 |
| Complexity | 246.0 |
Chemical Identifiers
| CAS Number | 66384-52-9 |
|---|---|
| SMILES | CCC1OCC(CO1)(C)OCC2=CC=CC=C2C |
| InChIKey | MROZEXUYEGHFEP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
cis-2-Ethyl-5-methyl-5-(2-methylbenzyloxy)-1,3-dioxane (CAS 66384-52-9), with molecular formula C15H22O3 and molecular weight 250.16 g/mol. IUPAC: 2-ethyl-5-methyl-5-[(2-methylphenyl)methoxy]-1,3-dioxane.
Chemical Property Profile of cis-2-Ethyl-5-methyl-5-(2-methylbenzyloxy)-1,3-dioxane
Property Insights of cis-2-Ethyl-5-methyl-5-(2-methylbenzyloxy)-1,3-dioxane
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for cis-2-Ethyl-5-methyl-5-(2-methylbenzyloxy)-1,3-dioxane. With a topological polar surface area (TPSA) of 27.7 Ų, cis-2-Ethyl-5-methyl-5-(2-methylbenzyloxy)-1,3-dioxane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, cis-2-Ethyl-5-methyl-5-(2-methylbenzyloxy)-1,3-dioxane 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 cis-2-Ethyl-5-methyl-5-(2-methylbenzyloxy)-1,3-dioxane?
The CAS number of cis-2-Ethyl-5-methyl-5-(2-methylbenzyloxy)-1,3-dioxane is 66384-52-9.
What is the molecular formula of cis-2-Ethyl-5-methyl-5-(2-methylbenzyloxy)-1,3-dioxane?
The molecular formula of cis-2-Ethyl-5-methyl-5-(2-methylbenzyloxy)-1,3-dioxane is C15H22O3.
What is the molecular weight of cis-2-Ethyl-5-methyl-5-(2-methylbenzyloxy)-1,3-dioxane?
The molecular weight of cis-2-Ethyl-5-methyl-5-(2-methylbenzyloxy)-1,3-dioxane is 250.16 g/mol.
Where can I buy cis-2-Ethyl-5-methyl-5-(2-methylbenzyloxy)-1,3-dioxane?
You can request a quote for cis-2-Ethyl-5-methyl-5-(2-methylbenzyloxy)-1,3-dioxane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for cis-2-Ethyl-5-methyl-5-(2-methylbenzyloxy)-1,3-dioxane?
Yes, KEHONG BIO provides custom synthesis services for cis-2-Ethyl-5-methyl-5-(2-methylbenzyloxy)-1,3-dioxane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.