4-Oxo-4-(2-phenanthryl)butanoic acid
TL;DR: 4-Oxo-4-(2-phenanthryl)butanoic acid (CAS 56609-60-0) is a chemical compound with molecular formula C18H14O3 and molecular weight 278.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-oxo-4-phenanthren-2-ylbutanoic acid
Also Known As: 4-oxo-4-(2-phenanthryl)butanoic acid, 4-oxo-4-phenanthren-2-ylbutanoic acid, 4-oxo-4-phenanthren-2-yl-butyric acid, 4-oxo-4-phenanthren-2-yl-butanoic Acid
| Molecular Formula | C18H14O3 |
|---|---|
| Molecular Weight | 278.09 g/mol |
| LogP | 4.0405 |
| Topological Polar Surface Area | 54.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 278.0943 |
| Heavy Atoms | 21 |
| Complexity | 849.336 |
Chemical Identifiers
| CAS Number | 56609-60-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC3=C2C=CC(=C3)C(=O)CCC(=O)O |
Product Overview
4-Oxo-4-(2-phenanthryl)butanoic acid (CAS 56609-60-0), with molecular formula C18H14O3 and molecular weight 278.09 g/mol. IUPAC: 4-oxo-4-phenanthren-2-ylbutanoic acid.
Chemical Property Profile of 4-Oxo-4-(2-phenanthryl)butanoic acid
Property Insights of 4-Oxo-4-(2-phenanthryl)butanoic acid
The XLogP value of 4.0405 indicates that 4-Oxo-4-(2-phenanthryl)butanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.37 Ų, 4-Oxo-4-(2-phenanthryl)butanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Oxo-4-(2-phenanthryl)butanoic acid has 1 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 4-Oxo-4-(2-phenanthryl)butanoic acid?
The CAS number of 4-Oxo-4-(2-phenanthryl)butanoic acid is 56609-60-0.
What is the molecular formula of 4-Oxo-4-(2-phenanthryl)butanoic acid?
The molecular formula of 4-Oxo-4-(2-phenanthryl)butanoic acid is C18H14O3.
What is the molecular weight of 4-Oxo-4-(2-phenanthryl)butanoic acid?
The molecular weight of 4-Oxo-4-(2-phenanthryl)butanoic acid is 278.09 g/mol.
Where can I buy 4-Oxo-4-(2-phenanthryl)butanoic acid?
You can request a quote for 4-Oxo-4-(2-phenanthryl)butanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Oxo-4-(2-phenanthryl)butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Oxo-4-(2-phenanthryl)butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.