![[4-(4-Bromophenyl)phenyl] benzenesulfonate structure](/static/products/5922/5922-42-9.webp)
[4-(4-Bromophenyl)phenyl] benzenesulfonate
TL;DR: [4-(4-Bromophenyl)phenyl] benzenesulfonate (CAS 5922-42-9) is a chemical compound with molecular formula C18H13BrO3S and molecular weight 387.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(4-bromophenyl)phenyl] benzenesulfonate
Also Known As: [4-(4-bromophenyl)phenyl] benzenesulfonate|4'-bromobiphenyl-4-yl benzenesulfonate|4-benzenesulphonyloxy-4'-bromobiphenyl|4'-bromo-4-benzene-sulphonyloxybiphenyl|4'-bromo[1,1'-biphenyl]-4-yl benzenesulfonate|[1,1'-Biphenyl]-4-ol,4'-bromo-, 4-benzenesulfonate|AE-534/30057053|WCZHJYJCMMUNDM-UHFFFAOYSA-N
| Molecular Formula | C18H13BrO3S |
|---|---|
| Molecular Weight | 387.98 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 387.97687 |
| Heavy Atoms | 23 |
| Complexity | 451.0 |
Chemical Identifiers
| CAS Number | 5922-42-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)Br |
| InChIKey | WCZHJYJCMMUNDM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
[4-(4-Bromophenyl)phenyl] benzenesulfonate (CAS 5922-42-9), with molecular formula C18H13BrO3S and molecular weight 387.98 g/mol. IUPAC: [4-(4-bromophenyl)phenyl] benzenesulfonate.
Chemical Property Profile of [4-(4-Bromophenyl)phenyl] benzenesulfonate
Property Insights of [4-(4-Bromophenyl)phenyl] benzenesulfonate
The XLogP value of 5.4 indicates that [4-(4-Bromophenyl)phenyl] benzenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.8 Ų, [4-(4-Bromophenyl)phenyl] benzenesulfonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [4-(4-Bromophenyl)phenyl] benzenesulfonate has 0 hydrogen bond donor(s) and 3 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-Bromophenyl)phenyl] benzenesulfonate?
The CAS number of [4-(4-Bromophenyl)phenyl] benzenesulfonate is 5922-42-9.
What is the molecular formula of [4-(4-Bromophenyl)phenyl] benzenesulfonate?
The molecular formula of [4-(4-Bromophenyl)phenyl] benzenesulfonate is C18H13BrO3S.
What is the molecular weight of [4-(4-Bromophenyl)phenyl] benzenesulfonate?
The molecular weight of [4-(4-Bromophenyl)phenyl] benzenesulfonate is 387.98 g/mol.
Where can I buy [4-(4-Bromophenyl)phenyl] benzenesulfonate?
You can request a quote for [4-(4-Bromophenyl)phenyl] benzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-(4-Bromophenyl)phenyl] benzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for [4-(4-Bromophenyl)phenyl] benzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.