3,3'-Methylenebis(2,4,6-trichlorophenol)
TL;DR: 3,3'-Methylenebis(2,4,6-trichlorophenol) (CAS 584-32-7) is a chemical compound with molecular formula C13H6Cl6O2 and molecular weight 403.85 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4,6-trichloro-3-[(2,4,6-trichloro-3-hydroxyphenyl)methyl]phenol
Also Known As: 3,3'-Methylenebis(2,4,6-trichlorophenol), 3,3 -Methylenebis(2,4,6-trichlorophenol), 2,4,6,2',4',6'-Hexachlor-3,3'-dihydroxydiphenylmethan, 2,4,6-trichloro-3-[(2,4,6-trichloro-3-hydroxyphenyl)methyl]phenol, 2,4,6-trichloro-3-[(2,4,6-trichloro-3-hydroxyphenyl)methyl]p
| Molecular Formula | C13H6Cl6O2 |
|---|---|
| Molecular Weight | 403.85 g/mol |
| LogP | 6.9 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 403.84988 |
| Heavy Atoms | 21 |
| Complexity | 328.0 |
Chemical Identifiers
| CAS Number | 584-32-7 |
|---|---|
| SMILES | C1=C(C(=C(C(=C1Cl)O)Cl)CC2=C(C(=C(C=C2Cl)Cl)O)Cl)Cl |
| InChIKey | ORLFPYAPIUHUAQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,3'-Methylenebis(2,4,6-trichlorophenol) (CAS 584-32-7), with molecular formula C13H6Cl6O2 and molecular weight 403.85 g/mol. IUPAC: 2,4,6-trichloro-3-[(2,4,6-trichloro-3-hydroxyphenyl)methyl]phenol.
Chemical Property Profile of 3,3'-Methylenebis(2,4,6-trichlorophenol)
Property Insights of 3,3'-Methylenebis(2,4,6-trichlorophenol)
The XLogP value of 6.9 indicates that 3,3'-Methylenebis(2,4,6-trichlorophenol) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, 3,3'-Methylenebis(2,4,6-trichlorophenol) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3'-Methylenebis(2,4,6-trichlorophenol) 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 3,3'-Methylenebis(2,4,6-trichlorophenol)?
The CAS number of 3,3'-Methylenebis(2,4,6-trichlorophenol) is 584-32-7.
What is the molecular formula of 3,3'-Methylenebis(2,4,6-trichlorophenol)?
The molecular formula of 3,3'-Methylenebis(2,4,6-trichlorophenol) is C13H6Cl6O2.
What is the molecular weight of 3,3'-Methylenebis(2,4,6-trichlorophenol)?
The molecular weight of 3,3'-Methylenebis(2,4,6-trichlorophenol) is 403.85 g/mol.
Where can I buy 3,3'-Methylenebis(2,4,6-trichlorophenol)?
You can request a quote for 3,3'-Methylenebis(2,4,6-trichlorophenol) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3'-Methylenebis(2,4,6-trichlorophenol)?
Yes, KEHONG BIO provides custom synthesis services for 3,3'-Methylenebis(2,4,6-trichlorophenol) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.