4,4'-Methylenebis[2,6-dibromophenol]
TL;DR: 4,4'-Methylenebis[2,6-dibromophenol] (CAS 21825-03-6) is a chemical compound with molecular formula C13H8Br4O2 and molecular weight 511.73 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-dibromo-4-[(3,5-dibromo-4-hydroxyphenyl)methyl]phenol
Also Known As: 4,4'-Methylenebis(2,6-dibromophenol), Phenol, 4,4'-methylenebis(2,6-dibromo-, Phenol,4,4'-methylenebis[2,6-dibromo-, di-(4-hydroxy-3,5-dibromophenyl)methane, 4,4 -Methylenebis(2,6-dibromophenol)
| Molecular Formula | C13H8Br4O2 |
|---|---|
| Molecular Weight | 511.73 g/mol |
| LogP | 5.9 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 515.7217 |
| Heavy Atoms | 19 |
| Complexity | 252.0 |
Chemical Identifiers
| CAS Number | 21825-03-6 |
|---|---|
| SMILES | C1=C(C=C(C(=C1Br)O)Br)CC2=CC(=C(C(=C2)Br)O)Br |
| InChIKey | WPZJSWWEEJJSIZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,4'-Methylenebis[2,6-dibromophenol] (CAS 21825-03-6), with molecular formula C13H8Br4O2 and molecular weight 511.73 g/mol. IUPAC: 2,6-dibromo-4-[(3,5-dibromo-4-hydroxyphenyl)methyl]phenol.
Chemical Property Profile of 4,4'-Methylenebis[2,6-dibromophenol]
Property Insights of 4,4'-Methylenebis[2,6-dibromophenol]
The XLogP value of 5.9 indicates that 4,4'-Methylenebis[2,6-dibromophenol] is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, 4,4'-Methylenebis[2,6-dibromophenol] exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4'-Methylenebis[2,6-dibromophenol] 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 4,4'-Methylenebis[2,6-dibromophenol]?
The CAS number of 4,4'-Methylenebis[2,6-dibromophenol] is 21825-03-6.
What is the molecular formula of 4,4'-Methylenebis[2,6-dibromophenol]?
The molecular formula of 4,4'-Methylenebis[2,6-dibromophenol] is C13H8Br4O2.
What is the molecular weight of 4,4'-Methylenebis[2,6-dibromophenol]?
The molecular weight of 4,4'-Methylenebis[2,6-dibromophenol] is 511.73 g/mol.
Where can I buy 4,4'-Methylenebis[2,6-dibromophenol]?
You can request a quote for 4,4'-Methylenebis[2,6-dibromophenol] directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4'-Methylenebis[2,6-dibromophenol]?
Yes, KEHONG BIO provides custom synthesis services for 4,4'-Methylenebis[2,6-dibromophenol] and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.