3,4-Dipentyloxybenzoic acid
TL;DR: 3,4-Dipentyloxybenzoic acid (CAS 179166-72-4) is a chemical compound with molecular formula C17H26O4 and molecular weight 294.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-dipentoxybenzoic acid
Also Known As: 3,4-dipentoxybenzoic Acid, 3,4-dipentyloxybenzoic acid
| Molecular Formula | C17H26O4 |
|---|---|
| Molecular Weight | 294.18 g/mol |
| LogP | 4.5228 |
| Topological Polar Surface Area | 55.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 11 |
| Exact Mass | 294.1831 |
| Heavy Atoms | 21 |
| Complexity | 428.79834 |
Chemical Identifiers
| CAS Number | 179166-72-4 |
|---|---|
| SMILES | CCCCCOC1=C(C=C(C=C1)C(=O)O)OCCCCC |
Product Overview
3,4-Dipentyloxybenzoic acid (CAS 179166-72-4), with molecular formula C17H26O4 and molecular weight 294.18 g/mol. IUPAC: 3,4-dipentoxybenzoic acid.
Chemical Property Profile of 3,4-Dipentyloxybenzoic acid
Property Insights of 3,4-Dipentyloxybenzoic acid
The XLogP value of 4.5228 indicates that 3,4-Dipentyloxybenzoic 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, 3,4-Dipentyloxybenzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-Dipentyloxybenzoic 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 3,4-Dipentyloxybenzoic acid?
The CAS number of 3,4-Dipentyloxybenzoic acid is 179166-72-4.
What is the molecular formula of 3,4-Dipentyloxybenzoic acid?
The molecular formula of 3,4-Dipentyloxybenzoic acid is C17H26O4.
What is the molecular weight of 3,4-Dipentyloxybenzoic acid?
The molecular weight of 3,4-Dipentyloxybenzoic acid is 294.18 g/mol.
Where can I buy 3,4-Dipentyloxybenzoic acid?
You can request a quote for 3,4-Dipentyloxybenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Dipentyloxybenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Dipentyloxybenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.