5-Methyl-2,3-dihydro-1,4-dioxine
TL;DR: 5-Methyl-2,3-dihydro-1,4-dioxine (CAS 3973-22-6) is a chemical compound with molecular formula C5H8O2 and molecular weight 100.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-2,3-dihydro-1,4-dioxine
Also Known As: 2,3-dihydro-5-methyl-1,4-dioxin, 5-Methyl-2,3-dihydro-1,4-dioxine, p-Dioxin,3-dihydro-5-methyl-, p-Dioxin, 2,3-dihydro-5-methyl-, 6-methyl-2,3-dihydro-1,4-dioxine
| Molecular Formula | C5H8O2 |
|---|---|
| Molecular Weight | 100.05 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 100.05243 |
| Heavy Atoms | 7 |
| Complexity | 86.0 |
Chemical Identifiers
| CAS Number | 3973-22-6 |
|---|---|
| SMILES | CC1=COCCO1 |
| InChIKey | DGZFPEFJNUNGAL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Methyl-2,3-dihydro-1,4-dioxine (CAS 3973-22-6), with molecular formula C5H8O2 and molecular weight 100.05 g/mol. IUPAC: 5-methyl-2,3-dihydro-1,4-dioxine.
Chemical Property Profile of 5-Methyl-2,3-dihydro-1,4-dioxine
Property Insights of 5-Methyl-2,3-dihydro-1,4-dioxine
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Methyl-2,3-dihydro-1,4-dioxine. With a topological polar surface area (TPSA) of 18.5 Ų, 5-Methyl-2,3-dihydro-1,4-dioxine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Methyl-2,3-dihydro-1,4-dioxine 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-Methyl-2,3-dihydro-1,4-dioxine?
The CAS number of 5-Methyl-2,3-dihydro-1,4-dioxine is 3973-22-6.
What is the molecular formula of 5-Methyl-2,3-dihydro-1,4-dioxine?
The molecular formula of 5-Methyl-2,3-dihydro-1,4-dioxine is C5H8O2.
What is the molecular weight of 5-Methyl-2,3-dihydro-1,4-dioxine?
The molecular weight of 5-Methyl-2,3-dihydro-1,4-dioxine is 100.05 g/mol.
Where can I buy 5-Methyl-2,3-dihydro-1,4-dioxine?
You can request a quote for 5-Methyl-2,3-dihydro-1,4-dioxine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Methyl-2,3-dihydro-1,4-dioxine?
Yes, KEHONG BIO provides custom synthesis services for 5-Methyl-2,3-dihydro-1,4-dioxine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.