4-Oxo-4-(4-pentylphenyl)butanoic acid
TL;DR: 4-Oxo-4-(4-pentylphenyl)butanoic acid (CAS 64779-07-3) is a chemical compound with molecular formula C15H20O3 and molecular weight 248.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-oxo-4-(4-pentylphenyl)butanoic acid
Also Known As: 4-oxo-4-(4-pentylphenyl)butanoic acid, Phenyl sulfone, Maybridge1_001938, 4-oxo-4-(4-n-pentylphenyl)butyric acid, 3-(4-n-pentylbenzoyl)propanoic acid
| Molecular Formula | C15H20O3 |
|---|---|
| Molecular Weight | 248.14 g/mol |
| LogP | 3.4668 |
| Topological Polar Surface Area | 54.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 248.14125 |
| Heavy Atoms | 18 |
| Complexity | 392.70468 |
Chemical Identifiers
| CAS Number | 64779-07-3 |
|---|---|
| SMILES | CCCCCC1=CC=C(C=C1)C(=O)CCC(=O)O |
Product Overview
4-Oxo-4-(4-pentylphenyl)butanoic acid (CAS 64779-07-3), with molecular formula C15H20O3 and molecular weight 248.14 g/mol. IUPAC: 4-oxo-4-(4-pentylphenyl)butanoic acid.
Chemical Property Profile of 4-Oxo-4-(4-pentylphenyl)butanoic acid
Property Insights of 4-Oxo-4-(4-pentylphenyl)butanoic acid
The XLogP value of 3.4668 indicates that 4-Oxo-4-(4-pentylphenyl)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-(4-pentylphenyl)butanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Oxo-4-(4-pentylphenyl)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-(4-pentylphenyl)butanoic acid?
The CAS number of 4-Oxo-4-(4-pentylphenyl)butanoic acid is 64779-07-3.
What is the molecular formula of 4-Oxo-4-(4-pentylphenyl)butanoic acid?
The molecular formula of 4-Oxo-4-(4-pentylphenyl)butanoic acid is C15H20O3.
What is the molecular weight of 4-Oxo-4-(4-pentylphenyl)butanoic acid?
The molecular weight of 4-Oxo-4-(4-pentylphenyl)butanoic acid is 248.14 g/mol.
Where can I buy 4-Oxo-4-(4-pentylphenyl)butanoic acid?
You can request a quote for 4-Oxo-4-(4-pentylphenyl)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-(4-pentylphenyl)butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Oxo-4-(4-pentylphenyl)butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.