2-(2-Fluorophenyl)-4,7-dihydro-1,3-dioxepine
TL;DR: 2-(2-Fluorophenyl)-4,7-dihydro-1,3-dioxepine (CAS 127391-89-3) is a chemical compound with molecular formula C11H11FO2 and molecular weight 194.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-fluorophenyl)-4,7-dihydro-1,3-dioxepine
Also Known As: 2-(2-fluorophenyl)-4,7-dihydro-1,3-dioxepine, 2-(2-fluorophenyl)-1,3-dioxepin-5-ene, 2-(2-fluorophenyl)-4,7-dihydro-2H-1,3-dioxepine, 10H-946
| Molecular Formula | C11H11FO2 |
|---|---|
| Molecular Weight | 194.07 g/mol |
| LogP | 2.4273 |
| Topological Polar Surface Area | 18.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 194.07431 |
| Heavy Atoms | 14 |
| Complexity | 325.81433 |
Chemical Identifiers
| CAS Number | 127391-89-3 |
|---|---|
| SMILES | C1C=CCOC(O1)C2=CC=CC=C2F |
Product Overview
2-(2-Fluorophenyl)-4,7-dihydro-1,3-dioxepine (CAS 127391-89-3), with molecular formula C11H11FO2 and molecular weight 194.07 g/mol. IUPAC: 2-(2-fluorophenyl)-4,7-dihydro-1,3-dioxepine.
Chemical Property Profile of 2-(2-Fluorophenyl)-4,7-dihydro-1,3-dioxepine
Property Insights of 2-(2-Fluorophenyl)-4,7-dihydro-1,3-dioxepine
The XLogP value of 2.4273 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-Fluorophenyl)-4,7-dihydro-1,3-dioxepine. With a topological polar surface area (TPSA) of 18.46 Ų, 2-(2-Fluorophenyl)-4,7-dihydro-1,3-dioxepine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Fluorophenyl)-4,7-dihydro-1,3-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 2-(2-Fluorophenyl)-4,7-dihydro-1,3-dioxepine?
The CAS number of 2-(2-Fluorophenyl)-4,7-dihydro-1,3-dioxepine is 127391-89-3.
What is the molecular formula of 2-(2-Fluorophenyl)-4,7-dihydro-1,3-dioxepine?
The molecular formula of 2-(2-Fluorophenyl)-4,7-dihydro-1,3-dioxepine is C11H11FO2.
What is the molecular weight of 2-(2-Fluorophenyl)-4,7-dihydro-1,3-dioxepine?
The molecular weight of 2-(2-Fluorophenyl)-4,7-dihydro-1,3-dioxepine is 194.07 g/mol.
Where can I buy 2-(2-Fluorophenyl)-4,7-dihydro-1,3-dioxepine?
You can request a quote for 2-(2-Fluorophenyl)-4,7-dihydro-1,3-dioxepine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Fluorophenyl)-4,7-dihydro-1,3-dioxepine?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Fluorophenyl)-4,7-dihydro-1,3-dioxepine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.