![2-{[3-(3-chloro-4-fluorophenyl)prop-2-ynyl]oxy}tetrahydro-2H-pyran structure](/static/products/6805/680579-99-1.webp)
2-{[3-(3-chloro-4-fluorophenyl)prop-2-ynyl]oxy}tetrahydro-2H-pyran
TL;DR: 2-{[3-(3-chloro-4-fluorophenyl)prop-2-ynyl]oxy}tetrahydro-2H-pyran (CAS 680579-99-1) is a chemical compound with molecular formula C14H14ClFO2 and molecular weight 268.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(3-chloro-4-fluorophenyl)prop-2-ynoxy]oxane
Also Known As: 2-{[3-(3-chloro-4-fluorophenyl)prop-2-ynyl]oxy}tetrahydro-2H-pyran, 2-[3-(3-chloro-4-fluorophenyl)prop-2-ynoxy]oxane, 2-{[3-(3-chloro-4-fluorophenyl)prop-2-yn-1-yl]oxy}oxane, 2-[3-(3-chloro-4-fluoro-phenyl)prop-2-ynoxy]tetrahydropyran, 2-[3-(3-Chloro-4-fluoro-phenyl)-prop-2-ynyloxy]-tetrahydro-pyran
| Molecular Formula | C14H14ClFO2 |
|---|---|
| Molecular Weight | 268.07 g/mol |
| LogP | 3.3738 |
| Topological Polar Surface Area | 18.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 268.06665 |
| Heavy Atoms | 18 |
| Complexity | 458.59717 |
Chemical Identifiers
| CAS Number | 680579-99-1 |
|---|---|
| SMILES | C1CCOC(C1)OCC#CC2=CC(=C(C=C2)F)Cl |
Product Overview
2-{[3-(3-chloro-4-fluorophenyl)prop-2-ynyl]oxy}tetrahydro-2H-pyran (CAS 680579-99-1), with molecular formula C14H14ClFO2 and molecular weight 268.07 g/mol. IUPAC: 2-[3-(3-chloro-4-fluorophenyl)prop-2-ynoxy]oxane.
Chemical Property Profile of 2-{[3-(3-chloro-4-fluorophenyl)prop-2-ynyl]oxy}tetrahydro-2H-pyran
Property Insights of 2-{[3-(3-chloro-4-fluorophenyl)prop-2-ynyl]oxy}tetrahydro-2H-pyran
The XLogP value of 3.3738 indicates that 2-{[3-(3-chloro-4-fluorophenyl)prop-2-ynyl]oxy}tetrahydro-2H-pyran is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.46 Ų, 2-{[3-(3-chloro-4-fluorophenyl)prop-2-ynyl]oxy}tetrahydro-2H-pyran exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-{[3-(3-chloro-4-fluorophenyl)prop-2-ynyl]oxy}tetrahydro-2H-pyran 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-{[3-(3-chloro-4-fluorophenyl)prop-2-ynyl]oxy}tetrahydro-2H-pyran?
The CAS number of 2-{[3-(3-chloro-4-fluorophenyl)prop-2-ynyl]oxy}tetrahydro-2H-pyran is 680579-99-1.
What is the molecular formula of 2-{[3-(3-chloro-4-fluorophenyl)prop-2-ynyl]oxy}tetrahydro-2H-pyran?
The molecular formula of 2-{[3-(3-chloro-4-fluorophenyl)prop-2-ynyl]oxy}tetrahydro-2H-pyran is C14H14ClFO2.
What is the molecular weight of 2-{[3-(3-chloro-4-fluorophenyl)prop-2-ynyl]oxy}tetrahydro-2H-pyran?
The molecular weight of 2-{[3-(3-chloro-4-fluorophenyl)prop-2-ynyl]oxy}tetrahydro-2H-pyran is 268.07 g/mol.
Where can I buy 2-{[3-(3-chloro-4-fluorophenyl)prop-2-ynyl]oxy}tetrahydro-2H-pyran?
You can request a quote for 2-{[3-(3-chloro-4-fluorophenyl)prop-2-ynyl]oxy}tetrahydro-2H-pyran directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{[3-(3-chloro-4-fluorophenyl)prop-2-ynyl]oxy}tetrahydro-2H-pyran?
Yes, KEHONG BIO provides custom synthesis services for 2-{[3-(3-chloro-4-fluorophenyl)prop-2-ynyl]oxy}tetrahydro-2H-pyran and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.