7-Methyl-2,3-dihydro-5H-1,4-dioxepine
TL;DR: 7-Methyl-2,3-dihydro-5H-1,4-dioxepine (CAS 38653-35-9) is a chemical compound with molecular formula C6H10O2 and molecular weight 114.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-methyl-3,5-dihydro-2H-1,4-dioxepine
Also Known As: 7-Methyl-2,3-dihydro-5H-1,4-dioxepine, 2,3-Dihydro-7-methyl-5H-1,4-dioxepin, 7-methyl-3,5-dihydro-2H-1,4-dioxepine, 5H-1,4-Dioxepin, 2,3-dihydro-7-methyl-, 7-methyl-2,3-dihydro-5H-[1,4]dioxepine
| Molecular Formula | C6H10O2 |
|---|---|
| Molecular Weight | 114.07 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 | 114.06808 |
| Heavy Atoms | 8 |
| Complexity | 96.0 |
Chemical Identifiers
| CAS Number | 38653-35-9 |
|---|---|
| SMILES | CC1=CCOCCO1 |
| InChIKey | MALWPRLLTVYAPN-UHFFFAOYSA-N |
Product Overview
7-Methyl-2,3-dihydro-5H-1,4-dioxepine (CAS 38653-35-9), with molecular formula C6H10O2 and molecular weight 114.07 g/mol. IUPAC: 7-methyl-3,5-dihydro-2H-1,4-dioxepine.
Chemical Property Profile of 7-Methyl-2,3-dihydro-5H-1,4-dioxepine
Property Insights of 7-Methyl-2,3-dihydro-5H-1,4-dioxepine
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Methyl-2,3-dihydro-5H-1,4-dioxepine. With a topological polar surface area (TPSA) of 18.5 Ų, 7-Methyl-2,3-dihydro-5H-1,4-dioxepine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Methyl-2,3-dihydro-5H-1,4-dioxepine 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 7-Methyl-2,3-dihydro-5H-1,4-dioxepine?
The CAS number of 7-Methyl-2,3-dihydro-5H-1,4-dioxepine is 38653-35-9.
What is the molecular formula of 7-Methyl-2,3-dihydro-5H-1,4-dioxepine?
The molecular formula of 7-Methyl-2,3-dihydro-5H-1,4-dioxepine is C6H10O2.
What is the molecular weight of 7-Methyl-2,3-dihydro-5H-1,4-dioxepine?
The molecular weight of 7-Methyl-2,3-dihydro-5H-1,4-dioxepine is 114.07 g/mol.
Where can I buy 7-Methyl-2,3-dihydro-5H-1,4-dioxepine?
You can request a quote for 7-Methyl-2,3-dihydro-5H-1,4-dioxepine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Methyl-2,3-dihydro-5H-1,4-dioxepine?
Yes, KEHONG BIO provides custom synthesis services for 7-Methyl-2,3-dihydro-5H-1,4-dioxepine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.