3-Styrenesulfonic acid
TL;DR: 3-Styrenesulfonic acid (CAS 46060-58-6) is a chemical compound with molecular formula C8H8O3S and molecular weight 184.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethenylbenzenesulfonic acid
Also Known As: 3-Styrenesulfonic acid, styrene-3-sulphonic acid, Benzenesulfonic acid, 3-ethenyl-, 3-ethenylbenzenesulfonic Acid
| Molecular Formula | C8H8O3S |
|---|---|
| Molecular Weight | 184.02 g/mol |
| LogP | 1.5763 |
| Topological Polar Surface Area | 54.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 184.01941 |
| Heavy Atoms | 12 |
| Complexity | 392.51892 |
Chemical Identifiers
| CAS Number | 46060-58-6 |
|---|---|
| SMILES | C=CC1=CC(=CC=C1)S(=O)(=O)O |
Product Overview
3-Styrenesulfonic acid (CAS 46060-58-6), with molecular formula C8H8O3S and molecular weight 184.02 g/mol. IUPAC: 3-ethenylbenzenesulfonic acid.
Chemical Property Profile of 3-Styrenesulfonic acid
Property Insights of 3-Styrenesulfonic acid
The XLogP value of 1.5763 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Styrenesulfonic acid. With a topological polar surface area (TPSA) of 54.37 Ų, 3-Styrenesulfonic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Styrenesulfonic acid has 1 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 3-Styrenesulfonic acid?
The CAS number of 3-Styrenesulfonic acid is 46060-58-6.
What is the molecular formula of 3-Styrenesulfonic acid?
The molecular formula of 3-Styrenesulfonic acid is C8H8O3S.
What is the molecular weight of 3-Styrenesulfonic acid?
The molecular weight of 3-Styrenesulfonic acid is 184.02 g/mol.
Where can I buy 3-Styrenesulfonic acid?
You can request a quote for 3-Styrenesulfonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Styrenesulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Styrenesulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.