2,3,5,6-Tetrachloro-4,4'-biphenyldiol
TL;DR: 2,3,5,6-Tetrachloro-4,4'-biphenyldiol (CAS 100702-98-5) is a chemical compound with molecular formula C12H6Cl4O2 and molecular weight 321.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,5,6-tetrachloro-4-(4-hydroxyphenyl)phenol
Also Known As: 2,3,5,6-Tetrachloro-4,4'-biphenyldiol, tetrachlorodihydroxybiphenyl, 2,3,5,6-Tetrachloro-4-(4-hydroxyphenyl)phenol, 2,3,5,6-tetrachloro-1,1'-biphenyl-4,4'-diol, 2,3,5,6-tetrachloro-[1,1'-biphenyl]-4,4'-diol
| Molecular Formula | C12H6Cl4O2 |
|---|---|
| Molecular Weight | 321.91 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 321.9122 |
| Heavy Atoms | 18 |
| Complexity | 267.0 |
Chemical Identifiers
| CAS Number | 100702-98-5 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=C(C(=C(C(=C2Cl)Cl)O)Cl)Cl)O |
| InChIKey | ZTJLKJPIKUPJIB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,3,5,6-Tetrachloro-4,4'-biphenyldiol (CAS 100702-98-5), with molecular formula C12H6Cl4O2 and molecular weight 321.91 g/mol. IUPAC: 2,3,5,6-tetrachloro-4-(4-hydroxyphenyl)phenol.
Chemical Property Profile of 2,3,5,6-Tetrachloro-4,4'-biphenyldiol
Property Insights of 2,3,5,6-Tetrachloro-4,4'-biphenyldiol
The XLogP value of 5.3 indicates that 2,3,5,6-Tetrachloro-4,4'-biphenyldiol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, 2,3,5,6-Tetrachloro-4,4'-biphenyldiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3,5,6-Tetrachloro-4,4'-biphenyldiol has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,3,5,6-Tetrachloro-4,4'-biphenyldiol?
The CAS number of 2,3,5,6-Tetrachloro-4,4'-biphenyldiol is 100702-98-5.
What is the molecular formula of 2,3,5,6-Tetrachloro-4,4'-biphenyldiol?
The molecular formula of 2,3,5,6-Tetrachloro-4,4'-biphenyldiol is C12H6Cl4O2.
What is the molecular weight of 2,3,5,6-Tetrachloro-4,4'-biphenyldiol?
The molecular weight of 2,3,5,6-Tetrachloro-4,4'-biphenyldiol is 321.91 g/mol.
Where can I buy 2,3,5,6-Tetrachloro-4,4'-biphenyldiol?
You can request a quote for 2,3,5,6-Tetrachloro-4,4'-biphenyldiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3,5,6-Tetrachloro-4,4'-biphenyldiol?
Yes, KEHONG BIO provides custom synthesis services for 2,3,5,6-Tetrachloro-4,4'-biphenyldiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.