Biphenyl-4-yl benzenesulfonate
TL;DR: Biphenyl-4-yl benzenesulfonate (CAS 37357-66-7) is a chemical compound with molecular formula C18H14O3S and molecular weight 310.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-phenylphenyl) benzenesulfonate
Also Known As: biphenyl-4-yl benzenesulfonate, (4-phenylphenyl) benzenesulfonate, 4-biphenylyl benzenesulfonate, [1,1'-BIPHENYL]-4-YL BENZENESULFONATE, Benzolsulfonsaeure-biphenyl-4-ylester
| Molecular Formula | C18H14O3S |
|---|---|
| Molecular Weight | 310.07 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 310.06638 |
| Heavy Atoms | 22 |
| Complexity | 420.0 |
Chemical Identifiers
| CAS Number | 37357-66-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC=C(C=C2)OS(=O)(=O)C3=CC=CC=C3 |
| InChIKey | HHZMCOMNTKMOPN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Biphenyl-4-yl benzenesulfonate (CAS 37357-66-7), with molecular formula C18H14O3S and molecular weight 310.07 g/mol. IUPAC: (4-phenylphenyl) benzenesulfonate.
Chemical Property Profile of Biphenyl-4-yl benzenesulfonate
Property Insights of Biphenyl-4-yl benzenesulfonate
The XLogP value of 4.7 indicates that Biphenyl-4-yl 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, Biphenyl-4-yl benzenesulfonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Biphenyl-4-yl benzenesulfonate has 0 hydrogen bond donor(s) and 3 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 Biphenyl-4-yl benzenesulfonate?
The CAS number of Biphenyl-4-yl benzenesulfonate is 37357-66-7.
What is the molecular formula of Biphenyl-4-yl benzenesulfonate?
The molecular formula of Biphenyl-4-yl benzenesulfonate is C18H14O3S.
What is the molecular weight of Biphenyl-4-yl benzenesulfonate?
The molecular weight of Biphenyl-4-yl benzenesulfonate is 310.07 g/mol.
Where can I buy Biphenyl-4-yl benzenesulfonate?
You can request a quote for Biphenyl-4-yl benzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Biphenyl-4-yl benzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for Biphenyl-4-yl benzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.