4-Octyloxy-benzoic acid, 4-hydroxy-phenyl ester
TL;DR: 4-Octyloxy-benzoic acid, 4-hydroxy-phenyl ester (CAS 33905-66-7) is a chemical compound with molecular formula C21H26O4 and molecular weight 342.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-hydroxyphenyl) 4-octoxybenzoate
Also Known As: (4-hydroxyphenyl) 4-octoxybenzoate, 4-HYDROXYPHENYL 4-(OCTYLOXY)BENZOATE, 4-Octyloxy-benzoic acid, 4-hydroxy-phenyl ester, 4-(Octyloxy)benzoic acid 4-hydroxyphenyl ester, 4-Octyloxy-benzoic acid 4-hydroxy-phenyl ester
| Molecular Formula | C21H26O4 |
|---|---|
| Molecular Weight | 342.18 g/mol |
| LogP | 5.3507 |
| Topological Polar Surface Area | 55.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 342.1831 |
| Heavy Atoms | 25 |
| Complexity | 631.95056 |
Chemical Identifiers
| CAS Number | 33905-66-7 |
|---|---|
| SMILES | CCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)O |
Product Overview
4-Octyloxy-benzoic acid, 4-hydroxy-phenyl ester (CAS 33905-66-7), with molecular formula C21H26O4 and molecular weight 342.18 g/mol. IUPAC: (4-hydroxyphenyl) 4-octoxybenzoate.
Chemical Property Profile of 4-Octyloxy-benzoic acid, 4-hydroxy-phenyl ester
Property Insights of 4-Octyloxy-benzoic acid, 4-hydroxy-phenyl ester
The XLogP value of 5.3507 indicates that 4-Octyloxy-benzoic acid, 4-hydroxy-phenyl ester 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-Octyloxy-benzoic acid, 4-hydroxy-phenyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Octyloxy-benzoic acid, 4-hydroxy-phenyl ester has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-Octyloxy-benzoic acid, 4-hydroxy-phenyl ester?
The CAS number of 4-Octyloxy-benzoic acid, 4-hydroxy-phenyl ester is 33905-66-7.
What is the molecular formula of 4-Octyloxy-benzoic acid, 4-hydroxy-phenyl ester?
The molecular formula of 4-Octyloxy-benzoic acid, 4-hydroxy-phenyl ester is C21H26O4.
What is the molecular weight of 4-Octyloxy-benzoic acid, 4-hydroxy-phenyl ester?
The molecular weight of 4-Octyloxy-benzoic acid, 4-hydroxy-phenyl ester is 342.18 g/mol.
Where can I buy 4-Octyloxy-benzoic acid, 4-hydroxy-phenyl ester?
You can request a quote for 4-Octyloxy-benzoic acid, 4-hydroxy-phenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Octyloxy-benzoic acid, 4-hydroxy-phenyl ester?
Yes, KEHONG BIO provides custom synthesis services for 4-Octyloxy-benzoic acid, 4-hydroxy-phenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.