4-(Hexyloxy)-3-methoxybenzenepropanoic acid
TL;DR: 4-(Hexyloxy)-3-methoxybenzenepropanoic acid (CAS 79669-12-8) is a chemical compound with molecular formula C16H24O4 and molecular weight 280.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-hexoxy-3-methoxyphenyl)propanoic acid
Also Known As: 3-(4-(Hexyloxy)-3-methoxyphenyl)propanoic acid, 4-(Hexyloxy)-3-methoxybenzenepropanoic acid, 3-(4-hexoxy-3-methoxyphenyl)propanoic acid, Benzenepropanoic acid, 4-(hexyloxy)-3-methoxy-, 3-(4-hexoxy-3-methoxy-phenyl)propanoic Acid
| Molecular Formula | C16H24O4 |
|---|---|
| Molecular Weight | 280.17 g/mol |
| LogP | 3.6715 |
| Topological Polar Surface Area | 55.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 280.16745 |
| Heavy Atoms | 20 |
| Complexity | 414.93793 |
Chemical Identifiers
| CAS Number | 79669-12-8 |
|---|---|
| SMILES | CCCCCCOC1=C(C=C(C=C1)CCC(=O)O)OC |
Product Overview
4-(Hexyloxy)-3-methoxybenzenepropanoic acid (CAS 79669-12-8), with molecular formula C16H24O4 and molecular weight 280.17 g/mol. IUPAC: 3-(4-hexoxy-3-methoxyphenyl)propanoic acid.
Chemical Property Profile of 4-(Hexyloxy)-3-methoxybenzenepropanoic acid
Property Insights of 4-(Hexyloxy)-3-methoxybenzenepropanoic acid
The XLogP value of 3.6715 indicates that 4-(Hexyloxy)-3-methoxybenzenepropanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.76 Ų, 4-(Hexyloxy)-3-methoxybenzenepropanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Hexyloxy)-3-methoxybenzenepropanoic acid 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 4-(Hexyloxy)-3-methoxybenzenepropanoic acid?
The CAS number of 4-(Hexyloxy)-3-methoxybenzenepropanoic acid is 79669-12-8.
What is the molecular formula of 4-(Hexyloxy)-3-methoxybenzenepropanoic acid?
The molecular formula of 4-(Hexyloxy)-3-methoxybenzenepropanoic acid is C16H24O4.
What is the molecular weight of 4-(Hexyloxy)-3-methoxybenzenepropanoic acid?
The molecular weight of 4-(Hexyloxy)-3-methoxybenzenepropanoic acid is 280.17 g/mol.
Where can I buy 4-(Hexyloxy)-3-methoxybenzenepropanoic acid?
You can request a quote for 4-(Hexyloxy)-3-methoxybenzenepropanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Hexyloxy)-3-methoxybenzenepropanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(Hexyloxy)-3-methoxybenzenepropanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.