4'-Ethynyl-3-fluoro-biphenyl
TL;DR: 4'-Ethynyl-3-fluoro-biphenyl (CAS 56917-33-0) is a chemical compound with molecular formula C14H9F and molecular weight 196.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethynyl-4-(3-fluorophenyl)benzene
Also Known As: 4'-Ethynyl-3-fluoro-biphenyl, 4'-Ethynyl-3-fluorobiphenyl, 1-ethynyl-4-(3-fluorophenyl)benzene, 4'-Ethynyl-3-fluoro-1,1'-biphenyl, A1-15024
| Molecular Formula | C14H9F |
|---|---|
| Molecular Weight | 196.07 g/mol |
| LogP | 3.474 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 196.06883 |
| Heavy Atoms | 15 |
| Complexity | 503.60706 |
Chemical Identifiers
| CAS Number | 56917-33-0 |
|---|---|
| SMILES | C#CC1=CC=C(C=C1)C2=CC(=CC=C2)F |
Product Overview
4'-Ethynyl-3-fluoro-biphenyl (CAS 56917-33-0), with molecular formula C14H9F and molecular weight 196.07 g/mol. IUPAC: 1-ethynyl-4-(3-fluorophenyl)benzene.
Chemical Property Profile of 4'-Ethynyl-3-fluoro-biphenyl
Property Insights of 4'-Ethynyl-3-fluoro-biphenyl
The XLogP value of 3.474 indicates that 4'-Ethynyl-3-fluoro-biphenyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 4'-Ethynyl-3-fluoro-biphenyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4'-Ethynyl-3-fluoro-biphenyl has 0 hydrogen bond donor(s) and 0 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 4'-Ethynyl-3-fluoro-biphenyl?
The CAS number of 4'-Ethynyl-3-fluoro-biphenyl is 56917-33-0.
What is the molecular formula of 4'-Ethynyl-3-fluoro-biphenyl?
The molecular formula of 4'-Ethynyl-3-fluoro-biphenyl is C14H9F.
What is the molecular weight of 4'-Ethynyl-3-fluoro-biphenyl?
The molecular weight of 4'-Ethynyl-3-fluoro-biphenyl is 196.07 g/mol.
Where can I buy 4'-Ethynyl-3-fluoro-biphenyl?
You can request a quote for 4'-Ethynyl-3-fluoro-biphenyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4'-Ethynyl-3-fluoro-biphenyl?
Yes, KEHONG BIO provides custom synthesis services for 4'-Ethynyl-3-fluoro-biphenyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.