2-Ethyl-5-methyl-1,4-dioxane
TL;DR: 2-Ethyl-5-methyl-1,4-dioxane (CAS 53907-91-8) is a chemical compound with molecular formula C7H14O2 and molecular weight 130.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethyl-5-methyl-1,4-dioxane
Also Known As: 2-ETHYL-5-METHYL-1,4-DIOXANE, 1,4-Dioxane, 2-ethyl-5-methyl-, 1,4-Dioxane,2-ethyl-5-methyl, 2-Ethyl-5-methyl-1,4-dioxane #
| Molecular Formula | C7H14O2 |
|---|---|
| Molecular Weight | 130.10 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 130.09938 |
| Heavy Atoms | 9 |
| Complexity | 83.0 |
Chemical Identifiers
| CAS Number | 53907-91-8 |
|---|---|
| SMILES | CCC1COC(CO1)C |
| InChIKey | DPXGZEPGOMVZDJ-UHFFFAOYSA-N |
Product Overview
2-Ethyl-5-methyl-1,4-dioxane (CAS 53907-91-8), with molecular formula C7H14O2 and molecular weight 130.10 g/mol. IUPAC: 2-ethyl-5-methyl-1,4-dioxane.
Chemical Property Profile of 2-Ethyl-5-methyl-1,4-dioxane
Property Insights of 2-Ethyl-5-methyl-1,4-dioxane
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Ethyl-5-methyl-1,4-dioxane. With a topological polar surface area (TPSA) of 18.5 Ų, 2-Ethyl-5-methyl-1,4-dioxane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Ethyl-5-methyl-1,4-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 2-Ethyl-5-methyl-1,4-dioxane?
The CAS number of 2-Ethyl-5-methyl-1,4-dioxane is 53907-91-8.
What is the molecular formula of 2-Ethyl-5-methyl-1,4-dioxane?
The molecular formula of 2-Ethyl-5-methyl-1,4-dioxane is C7H14O2.
What is the molecular weight of 2-Ethyl-5-methyl-1,4-dioxane?
The molecular weight of 2-Ethyl-5-methyl-1,4-dioxane is 130.10 g/mol.
Where can I buy 2-Ethyl-5-methyl-1,4-dioxane?
You can request a quote for 2-Ethyl-5-methyl-1,4-dioxane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Ethyl-5-methyl-1,4-dioxane?
Yes, KEHONG BIO provides custom synthesis services for 2-Ethyl-5-methyl-1,4-dioxane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.