4-(3-Chloro-4-hydroxyphenyl)benzoic acid
TL;DR: 4-(3-Chloro-4-hydroxyphenyl)benzoic acid (CAS 96460-02-5) is a chemical compound with molecular formula C13H9ClO3 and molecular weight 248.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3-chloro-4-hydroxyphenyl)benzoic acid
Also Known As: 4-(3-chloro-4-hydroxyphenyl)benzoic acid, 4-(4-CARBOXYPHENYL)-2-CHLOROPHENOL, 4-(3-chloro-4-hydroxy-phenyl)benzoic Acid, 4-(4-Carboxyphenyl)-2-chlorophenol, 95%, 3'-Chloro-4'-hydroxy-[1,1'-biphenyl]-4-carboxylic acid
| Molecular Formula | C13H9ClO3 |
|---|---|
| Molecular Weight | 248.02 g/mol |
| LogP | 3.4108 |
| Topological Polar Surface Area | 57.53 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 248.02402 |
| Heavy Atoms | 17 |
| Complexity | 561.3773 |
Chemical Identifiers
| CAS Number | 96460-02-5 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=CC(=C(C=C2)O)Cl)C(=O)O |
Product Overview
4-(3-Chloro-4-hydroxyphenyl)benzoic acid (CAS 96460-02-5), with molecular formula C13H9ClO3 and molecular weight 248.02 g/mol. IUPAC: 4-(3-chloro-4-hydroxyphenyl)benzoic acid.
Chemical Property Profile of 4-(3-Chloro-4-hydroxyphenyl)benzoic acid
Property Insights of 4-(3-Chloro-4-hydroxyphenyl)benzoic acid
The XLogP value of 3.4108 indicates that 4-(3-Chloro-4-hydroxyphenyl)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.53 Ų, 4-(3-Chloro-4-hydroxyphenyl)benzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(3-Chloro-4-hydroxyphenyl)benzoic acid has 2 hydrogen bond donor(s) and 2 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-(3-Chloro-4-hydroxyphenyl)benzoic acid?
The CAS number of 4-(3-Chloro-4-hydroxyphenyl)benzoic acid is 96460-02-5.
What is the molecular formula of 4-(3-Chloro-4-hydroxyphenyl)benzoic acid?
The molecular formula of 4-(3-Chloro-4-hydroxyphenyl)benzoic acid is C13H9ClO3.
What is the molecular weight of 4-(3-Chloro-4-hydroxyphenyl)benzoic acid?
The molecular weight of 4-(3-Chloro-4-hydroxyphenyl)benzoic acid is 248.02 g/mol.
Where can I buy 4-(3-Chloro-4-hydroxyphenyl)benzoic acid?
You can request a quote for 4-(3-Chloro-4-hydroxyphenyl)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(3-Chloro-4-hydroxyphenyl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(3-Chloro-4-hydroxyphenyl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.