5-Ethyl-2-methyl-2-phenyl-4-propyl-1,3-dioxane
TL;DR: 5-Ethyl-2-methyl-2-phenyl-4-propyl-1,3-dioxane (CAS 6952-21-2) is a chemical compound with molecular formula C16H24O2 and molecular weight 248.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-ethyl-2-methyl-2-phenyl-4-propyl-1,3-dioxane
Also Known As: hexyl phenoxyacetate, 5-ethyl-2-methyl-2-phenyl-4-propyl-1,3-dioxane
| Molecular Formula | C16H24O2 |
|---|---|
| Molecular Weight | 248.18 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 248.17763 |
| Heavy Atoms | 18 |
| Complexity | 247.0 |
Chemical Identifiers
| CAS Number | 6952-21-2 |
|---|---|
| SMILES | CCCC1C(COC(O1)(C)C2=CC=CC=C2)CC |
| InChIKey | HAYVOSGEKWGTKM-UHFFFAOYSA-N |
Product Overview
5-Ethyl-2-methyl-2-phenyl-4-propyl-1,3-dioxane (CAS 6952-21-2), with molecular formula C16H24O2 and molecular weight 248.18 g/mol. IUPAC: 5-ethyl-2-methyl-2-phenyl-4-propyl-1,3-dioxane.
Chemical Property Profile of 5-Ethyl-2-methyl-2-phenyl-4-propyl-1,3-dioxane
Property Insights of 5-Ethyl-2-methyl-2-phenyl-4-propyl-1,3-dioxane
The XLogP value of 4.0 indicates that 5-Ethyl-2-methyl-2-phenyl-4-propyl-1,3-dioxane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, 5-Ethyl-2-methyl-2-phenyl-4-propyl-1,3-dioxane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Ethyl-2-methyl-2-phenyl-4-propyl-1,3-dioxane 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 5-Ethyl-2-methyl-2-phenyl-4-propyl-1,3-dioxane?
The CAS number of 5-Ethyl-2-methyl-2-phenyl-4-propyl-1,3-dioxane is 6952-21-2.
What is the molecular formula of 5-Ethyl-2-methyl-2-phenyl-4-propyl-1,3-dioxane?
The molecular formula of 5-Ethyl-2-methyl-2-phenyl-4-propyl-1,3-dioxane is C16H24O2.
What is the molecular weight of 5-Ethyl-2-methyl-2-phenyl-4-propyl-1,3-dioxane?
The molecular weight of 5-Ethyl-2-methyl-2-phenyl-4-propyl-1,3-dioxane is 248.18 g/mol.
Where can I buy 5-Ethyl-2-methyl-2-phenyl-4-propyl-1,3-dioxane?
You can request a quote for 5-Ethyl-2-methyl-2-phenyl-4-propyl-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 5-Ethyl-2-methyl-2-phenyl-4-propyl-1,3-dioxane?
Yes, KEHONG BIO provides custom synthesis services for 5-Ethyl-2-methyl-2-phenyl-4-propyl-1,3-dioxane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.