4,4'-Dibromobenzil
TL;DR: 4,4'-Dibromobenzil (CAS 35578-47-3) is a chemical compound with molecular formula C14H8Br2O2 and molecular weight 365.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2-bis(4-bromophenyl)ethane-1,2-dione
Also Known As: 4,4'-Dibromobenzil, p,p'-Dibromobenzil, 4,4-dibromobenzil, 1,2-bis(4-bromophenyl)ethane-1,2-dione, Ethanedione, bis(4-bromophenyl)-
| Molecular Formula | C14H8Br2O2 |
|---|---|
| Molecular Weight | 365.89 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 367.88705 |
| Heavy Atoms | 18 |
| Complexity | 282.0 |
Chemical Identifiers
| CAS Number | 35578-47-3 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)C(=O)C2=CC=C(C=C2)Br)Br |
| InChIKey | NYCBYBDDECLFPE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,4'-Dibromobenzil (CAS 35578-47-3), with molecular formula C14H8Br2O2 and molecular weight 365.89 g/mol. IUPAC: 1,2-bis(4-bromophenyl)ethane-1,2-dione.
Chemical Property Profile of 4,4'-Dibromobenzil
Property Insights of 4,4'-Dibromobenzil
The XLogP value of 4.8 indicates that 4,4'-Dibromobenzil is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.1 Ų, 4,4'-Dibromobenzil exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4'-Dibromobenzil has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4,4'-Dibromobenzil?
The CAS number of 4,4'-Dibromobenzil is 35578-47-3.
What is the molecular formula of 4,4'-Dibromobenzil?
The molecular formula of 4,4'-Dibromobenzil is C14H8Br2O2.
What is the molecular weight of 4,4'-Dibromobenzil?
The molecular weight of 4,4'-Dibromobenzil is 365.89 g/mol.
Where can I buy 4,4'-Dibromobenzil?
You can request a quote for 4,4'-Dibromobenzil directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4'-Dibromobenzil?
Yes, KEHONG BIO provides custom synthesis services for 4,4'-Dibromobenzil and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.