1-(4'-Bromo-2'-fluorobiphenyl-4-yl)propan-1-one
TL;DR: 1-(4'-Bromo-2'-fluorobiphenyl-4-yl)propan-1-one (CAS 116831-22-2) is a chemical compound with molecular formula C15H12BrFO and molecular weight 306.00555 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[4-(4-bromo-2-fluorophenyl)phenyl]propan-1-one
Also Known As: 1-(4'-bromo-2'-fluorobiphenyl-4-yl)propan-1-one, 2-fluoro-4-bromo-4'-propionylbiphenyl, 2-Fluoro-4-bromo-4/'-propionylbiphenyl, 1-[4-(4-bromo-2-fluorophenyl)phenyl]propan-1-one, AA-516/33242058
Technical Specifications
| Molecular Formula | C15H12BrFO |
| Molecular Weight | 306.00555 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 306.00555 Da |
| Heavy Atoms | 18 |
| Complexity | 286.0 |
| SMILES | CCC(=O)C1=CC=C(C=C1)C2=C(C=C(C=C2)Br)F |
| InChIKey | QZZLMSXBQPHOTJ-UHFFFAOYSA-N |
Chemical Property Profile of 1-(4'-Bromo-2'-fluorobiphenyl-4-yl)propan-1-one
Property Insights of 1-(4'-Bromo-2'-fluorobiphenyl-4-yl)propan-1-one
The XLogP value of 4.5 indicates that 1-(4'-Bromo-2'-fluorobiphenyl-4-yl)propan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 1-(4'-Bromo-2'-fluorobiphenyl-4-yl)propan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4'-Bromo-2'-fluorobiphenyl-4-yl)propan-1-one 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
What is the CAS number of 1-(4'-Bromo-2'-fluorobiphenyl-4-yl)propan-1-one?
The CAS number of 1-(4'-Bromo-2'-fluorobiphenyl-4-yl)propan-1-one is 116831-22-2.
What is the molecular formula of 1-(4'-Bromo-2'-fluorobiphenyl-4-yl)propan-1-one?
The molecular formula of 1-(4'-Bromo-2'-fluorobiphenyl-4-yl)propan-1-one is C15H12BrFO.
What is the molecular weight of 1-(4'-Bromo-2'-fluorobiphenyl-4-yl)propan-1-one?
The molecular weight of 1-(4'-Bromo-2'-fluorobiphenyl-4-yl)propan-1-one is 306.00555 g/mol.
Where can I buy 1-(4'-Bromo-2'-fluorobiphenyl-4-yl)propan-1-one?
You can request a quote for 1-(4'-Bromo-2'-fluorobiphenyl-4-yl)propan-1-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(4'-Bromo-2'-fluorobiphenyl-4-yl)propan-1-one?
Yes, CoreyChem provides custom synthesis services for 1-(4'-Bromo-2'-fluorobiphenyl-4-yl)propan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.