5-Hydroxyfenclofenac
TL;DR: 5-Hydroxyfenclofenac (CAS 81605-86-9) is a chemical compound with molecular formula C14H10Cl2O4 and molecular weight 312.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(2,4-dichlorophenoxy)-5-hydroxyphenyl]acetic acid
Also Known As: 5-Hydroxyfenclofenac, Ketogan, Ketogin, Benzeneacetic acid, 2-(2,4-dichlorophenoxy)-5-hydroxy-, [2-(2,4-dichlorophenoxy)-5-hydroxyphenyl]acetic acid
| Molecular Formula | C14H10Cl2O4 |
|---|---|
| Molecular Weight | 312.00 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 311.9956 |
| Heavy Atoms | 20 |
| Complexity | 339.0 |
Chemical Identifiers
| CAS Number | 81605-86-9 |
|---|---|
| SMILES | C1=CC(=C(C=C1O)CC(=O)O)OC2=C(C=C(C=C2)Cl)Cl |
| InChIKey | BVEJJWHZLOVUCN-UHFFFAOYSA-N |
Product Overview
5-Hydroxyfenclofenac (CAS 81605-86-9), with molecular formula C14H10Cl2O4 and molecular weight 312.00 g/mol. IUPAC: 2-[2-(2,4-dichlorophenoxy)-5-hydroxyphenyl]acetic acid.
Chemical Property Profile of 5-Hydroxyfenclofenac
Property Insights of 5-Hydroxyfenclofenac
The XLogP value of 4.4 indicates that 5-Hydroxyfenclofenac is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Hydroxyfenclofenac. Following Lipinski's Rule of Five, 5-Hydroxyfenclofenac has 2 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 5-Hydroxyfenclofenac?
The CAS number of 5-Hydroxyfenclofenac is 81605-86-9.
What is the molecular formula of 5-Hydroxyfenclofenac?
The molecular formula of 5-Hydroxyfenclofenac is C14H10Cl2O4.
What is the molecular weight of 5-Hydroxyfenclofenac?
The molecular weight of 5-Hydroxyfenclofenac is 312.00 g/mol.
Where can I buy 5-Hydroxyfenclofenac?
You can request a quote for 5-Hydroxyfenclofenac directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Hydroxyfenclofenac?
Yes, KEHONG BIO provides custom synthesis services for 5-Hydroxyfenclofenac and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.