4,4-Bis-(3,5-dichloro-4-hydroxyphenyl)-valeric acid
TL;DR: 4,4-Bis-(3,5-dichloro-4-hydroxyphenyl)-valeric acid (CAS 16733-28-1) is a chemical compound with molecular formula C17H14Cl4O4 and molecular weight 421.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4-bis(3,5-dichloro-4-hydroxyphenyl)pentanoic acid
Also Known As: 4,4-bis(3,5-dichloro-4-hydroxyphenyl)pentanoic acid, 3,3 ,5,5 -Tetrachlorodiphenolic acid, J1.339.902F, 4,4-BIS-(3,5-DICHLORO-4-HYDROXYPHENYL)-VALERIC ACID, gamma,gamma-bis(3,5-DICHLORO-4-HYDROXYPHENYL)VALERIC ACID
| Molecular Formula | C17H14Cl4O4 |
|---|---|
| Molecular Weight | 421.96 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 77.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 421.96463 |
| Heavy Atoms | 25 |
| Complexity | 424.0 |
Chemical Identifiers
| CAS Number | 16733-28-1 |
|---|---|
| SMILES | CC(CCC(=O)O)(C1=CC(=C(C(=C1)Cl)O)Cl)C2=CC(=C(C(=C2)Cl)O)Cl |
| InChIKey | RXARJPRVMJJOJO-UHFFFAOYSA-N |
Product Overview
4,4-Bis-(3,5-dichloro-4-hydroxyphenyl)-valeric acid (CAS 16733-28-1), with molecular formula C17H14Cl4O4 and molecular weight 421.96 g/mol. IUPAC: 4,4-bis(3,5-dichloro-4-hydroxyphenyl)pentanoic acid.
Chemical Property Profile of 4,4-Bis-(3,5-dichloro-4-hydroxyphenyl)-valeric acid
Property Insights of 4,4-Bis-(3,5-dichloro-4-hydroxyphenyl)-valeric acid
The XLogP value of 5.8 indicates that 4,4-Bis-(3,5-dichloro-4-hydroxyphenyl)-valeric acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,4-Bis-(3,5-dichloro-4-hydroxyphenyl)-valeric acid. Following Lipinski's Rule of Five, 4,4-Bis-(3,5-dichloro-4-hydroxyphenyl)-valeric acid has 3 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 4,4-Bis-(3,5-dichloro-4-hydroxyphenyl)-valeric acid?
The CAS number of 4,4-Bis-(3,5-dichloro-4-hydroxyphenyl)-valeric acid is 16733-28-1.
What is the molecular formula of 4,4-Bis-(3,5-dichloro-4-hydroxyphenyl)-valeric acid?
The molecular formula of 4,4-Bis-(3,5-dichloro-4-hydroxyphenyl)-valeric acid is C17H14Cl4O4.
What is the molecular weight of 4,4-Bis-(3,5-dichloro-4-hydroxyphenyl)-valeric acid?
The molecular weight of 4,4-Bis-(3,5-dichloro-4-hydroxyphenyl)-valeric acid is 421.96 g/mol.
Where can I buy 4,4-Bis-(3,5-dichloro-4-hydroxyphenyl)-valeric acid?
You can request a quote for 4,4-Bis-(3,5-dichloro-4-hydroxyphenyl)-valeric acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4-Bis-(3,5-dichloro-4-hydroxyphenyl)-valeric acid?
Yes, KEHONG BIO provides custom synthesis services for 4,4-Bis-(3,5-dichloro-4-hydroxyphenyl)-valeric acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.