3,3'-Dibromobisphenol A
TL;DR: 3,3'-Dibromobisphenol A (CAS 67781-49-1) is a chemical compound with molecular formula C15H14Br2O2 and molecular weight 383.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-4-[2-(3-bromo-4-hydroxyphenyl)propan-2-yl]phenol
Also Known As: Dibromobisphenol A, 3,3'-Dibromobisphenol A, 4,4'-(propane-2,2-diyl)bis(2-bromophenol), 2,2 -Dibromobisphenol A, 3,3 -Dibromobisphenol A
| Molecular Formula | C15H14Br2O2 |
|---|---|
| Molecular Weight | 383.94 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 383.93604 |
| Heavy Atoms | 19 |
| Complexity | 281.0 |
Chemical Identifiers
| CAS Number | 67781-49-1 |
|---|---|
| SMILES | CC(C)(C1=CC(=C(C=C1)O)Br)C2=CC(=C(C=C2)O)Br |
| InChIKey | CKNCVRMXCLUOJI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,3'-Dibromobisphenol A (CAS 67781-49-1), with molecular formula C15H14Br2O2 and molecular weight 383.94 g/mol. IUPAC: 2-bromo-4-[2-(3-bromo-4-hydroxyphenyl)propan-2-yl]phenol.
Chemical Property Profile of 3,3'-Dibromobisphenol A
Property Insights of 3,3'-Dibromobisphenol A
The XLogP value of 5.4 indicates that 3,3'-Dibromobisphenol A 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'-Dibromobisphenol A exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3'-Dibromobisphenol A 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'-Dibromobisphenol A?
The CAS number of 3,3'-Dibromobisphenol A is 67781-49-1.
What is the molecular formula of 3,3'-Dibromobisphenol A?
The molecular formula of 3,3'-Dibromobisphenol A is C15H14Br2O2.
What is the molecular weight of 3,3'-Dibromobisphenol A?
The molecular weight of 3,3'-Dibromobisphenol A is 383.94 g/mol.
Where can I buy 3,3'-Dibromobisphenol A?
You can request a quote for 3,3'-Dibromobisphenol A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3'-Dibromobisphenol A?
Yes, KEHONG BIO provides custom synthesis services for 3,3'-Dibromobisphenol A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.