![4-[4-(Hexyloxy)phenyl]-4-oxobutanoic acid structure](/static/products/6477/64779-14-2.webp)
4-[4-(Hexyloxy)phenyl]-4-oxobutanoic acid
TL;DR: 4-[4-(Hexyloxy)phenyl]-4-oxobutanoic acid (CAS 64779-14-2) is a chemical compound with molecular formula C16H22O4 and molecular weight 278.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-hexoxyphenyl)-4-oxobutanoic acid
Also Known As: 4-[4-(hexyloxy)phenyl]-4-oxobutanoic acid, Maybridge1_002179, 4-(4-hexoxyphenyl)-4-oxobutanoic acid, 4-(4-hexyloxyphenyl)-4-oxobutyric acid, 4-(4-(Hexyloxy)phenyl)-4-oxobutanoic acid
| Molecular Formula | C16H22O4 |
|---|---|
| Molecular Weight | 278.15 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 278.1518 |
| Heavy Atoms | 20 |
| Complexity | 293.0 |
Chemical Identifiers
| CAS Number | 64779-14-2 |
|---|---|
| SMILES | CCCCCCOC1=CC=C(C=C1)C(=O)CCC(=O)O |
| InChIKey | MNOIELCLJGGCGM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-[4-(Hexyloxy)phenyl]-4-oxobutanoic acid (CAS 64779-14-2), with molecular formula C16H22O4 and molecular weight 278.15 g/mol. IUPAC: 4-(4-hexoxyphenyl)-4-oxobutanoic acid.
Chemical Property Profile of 4-[4-(Hexyloxy)phenyl]-4-oxobutanoic acid
Property Insights of 4-[4-(Hexyloxy)phenyl]-4-oxobutanoic acid
The XLogP value of 3.7 indicates that 4-[4-(Hexyloxy)phenyl]-4-oxobutanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[4-(Hexyloxy)phenyl]-4-oxobutanoic acid. Following Lipinski's Rule of Five, 4-[4-(Hexyloxy)phenyl]-4-oxobutanoic acid has 1 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 4-[4-(Hexyloxy)phenyl]-4-oxobutanoic acid?
The CAS number of 4-[4-(Hexyloxy)phenyl]-4-oxobutanoic acid is 64779-14-2.
What is the molecular formula of 4-[4-(Hexyloxy)phenyl]-4-oxobutanoic acid?
The molecular formula of 4-[4-(Hexyloxy)phenyl]-4-oxobutanoic acid is C16H22O4.
What is the molecular weight of 4-[4-(Hexyloxy)phenyl]-4-oxobutanoic acid?
The molecular weight of 4-[4-(Hexyloxy)phenyl]-4-oxobutanoic acid is 278.15 g/mol.
Where can I buy 4-[4-(Hexyloxy)phenyl]-4-oxobutanoic acid?
You can request a quote for 4-[4-(Hexyloxy)phenyl]-4-oxobutanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[4-(Hexyloxy)phenyl]-4-oxobutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[4-(Hexyloxy)phenyl]-4-oxobutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.