![2-Methyl-[1,4,2]dioxazinane structure](/static/products/521/52169-68-3.png)
2-Methyl-[1,4,2]dioxazinane
TL;DR: 2-Methyl-[1,4,2]dioxazinane (CAS 52169-68-3) is a chemical compound with molecular formula C4H9NO2 and molecular weight 103.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-1,4,2-dioxazinane
Also Known As: 2-methyl-[1,4,2]dioxazinane, 2-methyl-1,4,2-dioxazinane, 1,4,2-dioxazine, tetrahydro-2-methyl-, InChI=1/C4H9NO2/c1-5-4-6-2-3-7-5/h2-4H2,1H
| Molecular Formula | C4H9NO2 |
|---|---|
| Molecular Weight | 103.06 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 21.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 103.06333 |
| Heavy Atoms | 7 |
| Complexity | 57.0 |
Chemical Identifiers
| CAS Number | 52169-68-3 |
|---|---|
| SMILES | CN1COCCO1 |
| InChIKey | BMQBBOAAEIOIEB-UHFFFAOYSA-N |
Product Overview
2-Methyl-[1,4,2]dioxazinane (CAS 52169-68-3), with molecular formula C4H9NO2 and molecular weight 103.06 g/mol. IUPAC: 2-methyl-1,4,2-dioxazinane.
Chemical Property Profile of 2-Methyl-[1,4,2]dioxazinane
Property Insights of 2-Methyl-[1,4,2]dioxazinane
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-[1,4,2]dioxazinane. With a topological polar surface area (TPSA) of 21.7 Ų, 2-Methyl-[1,4,2]dioxazinane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-[1,4,2]dioxazinane 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-Methyl-[1,4,2]dioxazinane?
The CAS number of 2-Methyl-[1,4,2]dioxazinane is 52169-68-3.
What is the molecular formula of 2-Methyl-[1,4,2]dioxazinane?
The molecular formula of 2-Methyl-[1,4,2]dioxazinane is C4H9NO2.
What is the molecular weight of 2-Methyl-[1,4,2]dioxazinane?
The molecular weight of 2-Methyl-[1,4,2]dioxazinane is 103.06 g/mol.
Where can I buy 2-Methyl-[1,4,2]dioxazinane?
You can request a quote for 2-Methyl-[1,4,2]dioxazinane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-[1,4,2]dioxazinane?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-[1,4,2]dioxazinane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.