![[5-(4,4,4-Trifluoro-3-oxobutanoyl)naphthalen-1-yl]boronic acid structure](/static/products/244/244014-74-2.png)
[5-(4,4,4-Trifluoro-3-oxobutanoyl)naphthalen-1-yl]boronic acid
TL;DR: [5-(4,4,4-Trifluoro-3-oxobutanoyl)naphthalen-1-yl]boronic acid (CAS 244014-74-2) is a chemical compound with molecular formula C14H10BF3O4 and molecular weight 310.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-(4,4,4-trifluoro-3-oxobutanoyl)naphthalen-1-yl]boronic acid
Also Known As: [5-(4,4,4-trifluoro-3-oxo-butanoyl)naphthalen-1-yl]boronic Acid|[5-(4,4,4-Trifluoro-3-oxobutanoyl)naphthalen-1-yl]boronic acid|OXVNIDGJFRPKFB-UHFFFAOYSA-N
| Molecular Formula | C14H10BF3O4 |
|---|---|
| Molecular Weight | 310.06 g/mol |
| LogP | 1.2238 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 310.0624 |
| Heavy Atoms | 22 |
| Complexity | 740.4356 |
Chemical Identifiers
| CAS Number | 244014-74-2 |
|---|---|
| SMILES | B(C1=C2C=CC=C(C2=CC=C1)C(=O)CC(=O)C(F)(F)F)(O)O |
Product Overview
[5-(4,4,4-Trifluoro-3-oxobutanoyl)naphthalen-1-yl]boronic acid (CAS 244014-74-2), with molecular formula C14H10BF3O4 and molecular weight 310.06 g/mol. IUPAC: [5-(4,4,4-trifluoro-3-oxobutanoyl)naphthalen-1-yl]boronic acid.
Chemical Property Profile of [5-(4,4,4-Trifluoro-3-oxobutanoyl)naphthalen-1-yl]boronic acid
Property Insights of [5-(4,4,4-Trifluoro-3-oxobutanoyl)naphthalen-1-yl]boronic acid
The XLogP value of 1.2238 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [5-(4,4,4-Trifluoro-3-oxobutanoyl)naphthalen-1-yl]boronic acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for [5-(4,4,4-Trifluoro-3-oxobutanoyl)naphthalen-1-yl]boronic acid. Following Lipinski's Rule of Five, [5-(4,4,4-Trifluoro-3-oxobutanoyl)naphthalen-1-yl]boronic acid has 2 hydrogen bond donor(s) and 4 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 [5-(4,4,4-Trifluoro-3-oxobutanoyl)naphthalen-1-yl]boronic acid?
The CAS number of [5-(4,4,4-Trifluoro-3-oxobutanoyl)naphthalen-1-yl]boronic acid is 244014-74-2.
What is the molecular formula of [5-(4,4,4-Trifluoro-3-oxobutanoyl)naphthalen-1-yl]boronic acid?
The molecular formula of [5-(4,4,4-Trifluoro-3-oxobutanoyl)naphthalen-1-yl]boronic acid is C14H10BF3O4.
What is the molecular weight of [5-(4,4,4-Trifluoro-3-oxobutanoyl)naphthalen-1-yl]boronic acid?
The molecular weight of [5-(4,4,4-Trifluoro-3-oxobutanoyl)naphthalen-1-yl]boronic acid is 310.06 g/mol.
Where can I buy [5-(4,4,4-Trifluoro-3-oxobutanoyl)naphthalen-1-yl]boronic acid?
You can request a quote for [5-(4,4,4-Trifluoro-3-oxobutanoyl)naphthalen-1-yl]boronic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [5-(4,4,4-Trifluoro-3-oxobutanoyl)naphthalen-1-yl]boronic acid?
Yes, KEHONG BIO provides custom synthesis services for [5-(4,4,4-Trifluoro-3-oxobutanoyl)naphthalen-1-yl]boronic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.