5-butyl-5-ethyl-2-[(Z)-prop-1-enyl]-1,3-dioxane
TL;DR: 5-butyl-5-ethyl-2-[(Z)-prop-1-enyl]-1,3-dioxane (CAS 5421-07-8) is a chemical compound with molecular formula C13H24O2 and molecular weight 212.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-butyl-5-ethyl-2-[(Z)-prop-1-enyl]-1,3-dioxane
Also Known As: 5-butyl-5-ethyl-2-[(Z)-prop-1-enyl]-1,3-dioxane, 5-Butyl-5-ethyl-2-[(1Z)-prop-1-en-1-yl]-1,3-dioxane
| Molecular Formula | C13H24O2 |
|---|---|
| Molecular Weight | 212.18 g/mol |
| LogP | 3.522 |
| Topological Polar Surface Area | 18.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 212.17763 |
| Heavy Atoms | 15 |
| Complexity | 190.71263 |
Chemical Identifiers
| CAS Number | 5421-07-8 |
|---|---|
| SMILES | CCCCC1(COC(OC1)/C=C\C)CC |
Product Overview
5-butyl-5-ethyl-2-[(Z)-prop-1-enyl]-1,3-dioxane (CAS 5421-07-8), with molecular formula C13H24O2 and molecular weight 212.18 g/mol. IUPAC: 5-butyl-5-ethyl-2-[(Z)-prop-1-enyl]-1,3-dioxane.
Chemical Property Profile of 5-butyl-5-ethyl-2-[(Z)-prop-1-enyl]-1,3-dioxane
Property Insights of 5-butyl-5-ethyl-2-[(Z)-prop-1-enyl]-1,3-dioxane
The XLogP value of 3.522 indicates that 5-butyl-5-ethyl-2-[(Z)-prop-1-enyl]-1,3-dioxane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.46 Ų, 5-butyl-5-ethyl-2-[(Z)-prop-1-enyl]-1,3-dioxane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-butyl-5-ethyl-2-[(Z)-prop-1-enyl]-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-butyl-5-ethyl-2-[(Z)-prop-1-enyl]-1,3-dioxane?
The CAS number of 5-butyl-5-ethyl-2-[(Z)-prop-1-enyl]-1,3-dioxane is 5421-07-8.
What is the molecular formula of 5-butyl-5-ethyl-2-[(Z)-prop-1-enyl]-1,3-dioxane?
The molecular formula of 5-butyl-5-ethyl-2-[(Z)-prop-1-enyl]-1,3-dioxane is C13H24O2.
What is the molecular weight of 5-butyl-5-ethyl-2-[(Z)-prop-1-enyl]-1,3-dioxane?
The molecular weight of 5-butyl-5-ethyl-2-[(Z)-prop-1-enyl]-1,3-dioxane is 212.18 g/mol.
Where can I buy 5-butyl-5-ethyl-2-[(Z)-prop-1-enyl]-1,3-dioxane?
You can request a quote for 5-butyl-5-ethyl-2-[(Z)-prop-1-enyl]-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-butyl-5-ethyl-2-[(Z)-prop-1-enyl]-1,3-dioxane?
Yes, KEHONG BIO provides custom synthesis services for 5-butyl-5-ethyl-2-[(Z)-prop-1-enyl]-1,3-dioxane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.