1-(3-Bromo-5-fluoro-4-hydroxyphenyl)pentan-1-one
TL;DR: 1-(3-Bromo-5-fluoro-4-hydroxyphenyl)pentan-1-one (CAS 54340-63-5) is a chemical compound with molecular formula C11H12BrFO2 and molecular weight 274.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-bromo-5-fluoro-4-hydroxyphenyl)pentan-1-one
Also Known As: 3-Brom-4-nitroacetophenon, KST-1B5238, 1-(3-bromo-5-fluoro-4-hydroxyphenyl)pentan-1-one, 4-CHLORO-1H-INDOL-3-METHYLAMINE, 1-(3-bromo-5-fluoro-4-hydroxyphenyl)-1-pentanone
| Molecular Formula | C11H12BrFO2 |
|---|---|
| Molecular Weight | 274.00 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 274.00046 |
| Heavy Atoms | 15 |
| Complexity | 223.0 |
Chemical Identifiers
| CAS Number | 54340-63-5 |
|---|---|
| SMILES | CCCCC(=O)C1=CC(=C(C(=C1)Br)O)F |
| InChIKey | UFJABBBVDDWVEQ-UHFFFAOYSA-N |
Product Overview
1-(3-Bromo-5-fluoro-4-hydroxyphenyl)pentan-1-one (CAS 54340-63-5), with molecular formula C11H12BrFO2 and molecular weight 274.00 g/mol. IUPAC: 1-(3-bromo-5-fluoro-4-hydroxyphenyl)pentan-1-one.
Chemical Property Profile of 1-(3-Bromo-5-fluoro-4-hydroxyphenyl)pentan-1-one
Property Insights of 1-(3-Bromo-5-fluoro-4-hydroxyphenyl)pentan-1-one
The XLogP value of 3.4 indicates that 1-(3-Bromo-5-fluoro-4-hydroxyphenyl)pentan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 1-(3-Bromo-5-fluoro-4-hydroxyphenyl)pentan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-Bromo-5-fluoro-4-hydroxyphenyl)pentan-1-one has 1 hydrogen bond donor(s) and 3 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 1-(3-Bromo-5-fluoro-4-hydroxyphenyl)pentan-1-one?
The CAS number of 1-(3-Bromo-5-fluoro-4-hydroxyphenyl)pentan-1-one is 54340-63-5.
What is the molecular formula of 1-(3-Bromo-5-fluoro-4-hydroxyphenyl)pentan-1-one?
The molecular formula of 1-(3-Bromo-5-fluoro-4-hydroxyphenyl)pentan-1-one is C11H12BrFO2.
What is the molecular weight of 1-(3-Bromo-5-fluoro-4-hydroxyphenyl)pentan-1-one?
The molecular weight of 1-(3-Bromo-5-fluoro-4-hydroxyphenyl)pentan-1-one is 274.00 g/mol.
Where can I buy 1-(3-Bromo-5-fluoro-4-hydroxyphenyl)pentan-1-one?
You can request a quote for 1-(3-Bromo-5-fluoro-4-hydroxyphenyl)pentan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-Bromo-5-fluoro-4-hydroxyphenyl)pentan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Bromo-5-fluoro-4-hydroxyphenyl)pentan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.