3,3'-Difluoro-1,1'-biphenyl
TL;DR: 3,3'-Difluoro-1,1'-biphenyl (CAS 396-64-5) is a chemical compound with molecular formula C12H8F2 and molecular weight 190.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-fluoro-3-(3-fluorophenyl)benzene
Also Known As: 3,3'-DIFLUOROBIPHENYL, 3,3'-Difluoro-1,1'-biphenyl, 1-fluoro-3-(3-fluorophenyl)benzene, 1,1'-Biphenyl, 3,3'-difluoro-, 3,3 -Difluorobiphenyl
| Molecular Formula | C12H8F2 |
|---|---|
| Molecular Weight | 190.06 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 190.0594 |
| Heavy Atoms | 14 |
| Complexity | 161.0 |
Chemical Identifiers
| CAS Number | 396-64-5 |
|---|---|
| SMILES | C1=CC(=CC(=C1)F)C2=CC(=CC=C2)F |
| InChIKey | GAYJHUJLHJWCTH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,3'-Difluoro-1,1'-biphenyl (CAS 396-64-5), with molecular formula C12H8F2 and molecular weight 190.06 g/mol. IUPAC: 1-fluoro-3-(3-fluorophenyl)benzene.
Chemical Property Profile of 3,3'-Difluoro-1,1'-biphenyl
Property Insights of 3,3'-Difluoro-1,1'-biphenyl
The XLogP value of 3.7 indicates that 3,3'-Difluoro-1,1'-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, 3,3'-Difluoro-1,1'-biphenyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3'-Difluoro-1,1'-biphenyl 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 3,3'-Difluoro-1,1'-biphenyl?
The CAS number of 3,3'-Difluoro-1,1'-biphenyl is 396-64-5.
What is the molecular formula of 3,3'-Difluoro-1,1'-biphenyl?
The molecular formula of 3,3'-Difluoro-1,1'-biphenyl is C12H8F2.
What is the molecular weight of 3,3'-Difluoro-1,1'-biphenyl?
The molecular weight of 3,3'-Difluoro-1,1'-biphenyl is 190.06 g/mol.
Where can I buy 3,3'-Difluoro-1,1'-biphenyl?
You can request a quote for 3,3'-Difluoro-1,1'-biphenyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3'-Difluoro-1,1'-biphenyl?
Yes, KEHONG BIO provides custom synthesis services for 3,3'-Difluoro-1,1'-biphenyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.