2-(4-Methoxyphenyl)-5-methyl-5-propyl-1,3-dioxane
TL;DR: 2-(4-Methoxyphenyl)-5-methyl-5-propyl-1,3-dioxane (CAS 6972-91-4) 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-(4-methoxyphenyl)-5-methyl-5-propyl-1,3-dioxane
Also Known As: phenethyl dodecanoate, 2-(4-methoxyphenyl)-5-methyl-5-propyl-1,3-dioxane
| Molecular Formula | C15H22O3 |
|---|---|
| Molecular Weight | 250.16 g/mol |
| LogP | 3.4 |
| 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 | 238.0 |
Chemical Identifiers
| CAS Number | 6972-91-4 |
|---|---|
| SMILES | CCCC1(COC(OC1)C2=CC=C(C=C2)OC)C |
| InChIKey | SPOPJLQZTJUYLB-UHFFFAOYSA-N |
Product Overview
2-(4-Methoxyphenyl)-5-methyl-5-propyl-1,3-dioxane (CAS 6972-91-4), with molecular formula C15H22O3 and molecular weight 250.16 g/mol. IUPAC: 2-(4-methoxyphenyl)-5-methyl-5-propyl-1,3-dioxane.
Chemical Property Profile of 2-(4-Methoxyphenyl)-5-methyl-5-propyl-1,3-dioxane
Property Insights of 2-(4-Methoxyphenyl)-5-methyl-5-propyl-1,3-dioxane
The XLogP value of 3.4 indicates that 2-(4-Methoxyphenyl)-5-methyl-5-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 27.7 Ų, 2-(4-Methoxyphenyl)-5-methyl-5-propyl-1,3-dioxane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Methoxyphenyl)-5-methyl-5-propyl-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 2-(4-Methoxyphenyl)-5-methyl-5-propyl-1,3-dioxane?
The CAS number of 2-(4-Methoxyphenyl)-5-methyl-5-propyl-1,3-dioxane is 6972-91-4.
What is the molecular formula of 2-(4-Methoxyphenyl)-5-methyl-5-propyl-1,3-dioxane?
The molecular formula of 2-(4-Methoxyphenyl)-5-methyl-5-propyl-1,3-dioxane is C15H22O3.
What is the molecular weight of 2-(4-Methoxyphenyl)-5-methyl-5-propyl-1,3-dioxane?
The molecular weight of 2-(4-Methoxyphenyl)-5-methyl-5-propyl-1,3-dioxane is 250.16 g/mol.
Where can I buy 2-(4-Methoxyphenyl)-5-methyl-5-propyl-1,3-dioxane?
You can request a quote for 2-(4-Methoxyphenyl)-5-methyl-5-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 2-(4-Methoxyphenyl)-5-methyl-5-propyl-1,3-dioxane?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Methoxyphenyl)-5-methyl-5-propyl-1,3-dioxane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.