2-Propen-1-one, 1-(4-bromophenyl)-3-(4-fluorophenyl)-
TL;DR: 2-Propen-1-one, 1-(4-bromophenyl)-3-(4-fluorophenyl)- (CAS 98991-32-3) is a chemical compound with molecular formula C15H10BrFO and molecular weight 303.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-bromophenyl)-3-(4-fluorophenyl)prop-2-en-1-one
Also Known As: 4-Fluoro-4'-bromochalcone, 1-(4-bromophenyl)-3-(4-fluorophenyl)prop-2-en-1-one, 2-Propen-1-one, 1-(4-bromophenyl)-3-(4-fluorophenyl)-, (2E)-1-(4-bromophenyl)-3-(4-fluorophenyl)prop-2-en-1-one, 3-(4-fluorophenyl)-1-(4-bromophenyl)-2-propen-1-one
| Molecular Formula | C15H10BrFO |
|---|---|
| Molecular Weight | 303.99 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 303.9899 |
| Heavy Atoms | 18 |
| Complexity | 300.0 |
Chemical Identifiers
| CAS Number | 98991-32-3 |
|---|---|
| SMILES | C1=CC(=CC=C1C=CC(=O)C2=CC=C(C=C2)Br)F |
| InChIKey | JLKQXQSMJJGERH-UHFFFAOYSA-N |
Product Overview
2-Propen-1-one, 1-(4-bromophenyl)-3-(4-fluorophenyl)- (CAS 98991-32-3), with molecular formula C15H10BrFO and molecular weight 303.99 g/mol. IUPAC: 1-(4-bromophenyl)-3-(4-fluorophenyl)prop-2-en-1-one.
Chemical Property Profile of 2-Propen-1-one, 1-(4-bromophenyl)-3-(4-fluorophenyl)-
Property Insights of 2-Propen-1-one, 1-(4-bromophenyl)-3-(4-fluorophenyl)-
The XLogP value of 3.9 indicates that 2-Propen-1-one, 1-(4-bromophenyl)-3-(4-fluorophenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 2-Propen-1-one, 1-(4-bromophenyl)-3-(4-fluorophenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propen-1-one, 1-(4-bromophenyl)-3-(4-fluorophenyl)- 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-Propen-1-one, 1-(4-bromophenyl)-3-(4-fluorophenyl)-?
The CAS number of 2-Propen-1-one, 1-(4-bromophenyl)-3-(4-fluorophenyl)- is 98991-32-3.
What is the molecular formula of 2-Propen-1-one, 1-(4-bromophenyl)-3-(4-fluorophenyl)-?
The molecular formula of 2-Propen-1-one, 1-(4-bromophenyl)-3-(4-fluorophenyl)- is C15H10BrFO.
What is the molecular weight of 2-Propen-1-one, 1-(4-bromophenyl)-3-(4-fluorophenyl)-?
The molecular weight of 2-Propen-1-one, 1-(4-bromophenyl)-3-(4-fluorophenyl)- is 303.99 g/mol.
Where can I buy 2-Propen-1-one, 1-(4-bromophenyl)-3-(4-fluorophenyl)-?
You can request a quote for 2-Propen-1-one, 1-(4-bromophenyl)-3-(4-fluorophenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propen-1-one, 1-(4-bromophenyl)-3-(4-fluorophenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Propen-1-one, 1-(4-bromophenyl)-3-(4-fluorophenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.