Hydroxy(phenyl)methanesulfonic acid
TL;DR: Hydroxy(phenyl)methanesulfonic acid (CAS 4389-41-7) is a chemical compound with molecular formula C7H8O4S and molecular weight 188.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
hydroxy(phenyl)methanesulfonic acid
Also Known As: hydroxy(phenyl)methanesulfonic acid, sulfobenzyl alcohol, Hydroxy-phenyl-methanesulfonic acid, Benzenemethanesulfonic acid, .alpha.-hydroxy-, monosodium salt
| Molecular Formula | C7H8O4S |
|---|---|
| Molecular Weight | 188.01 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 83.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 188.01433 |
| Heavy Atoms | 12 |
| Complexity | 222.0 |
Chemical Identifiers
| CAS Number | 4389-41-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(O)S(=O)(=O)O |
| InChIKey | DNZPFPGYVWVLCE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Hydroxy(phenyl)methanesulfonic acid (CAS 4389-41-7), with molecular formula C7H8O4S and molecular weight 188.01 g/mol. IUPAC: hydroxy(phenyl)methanesulfonic acid.
Chemical Property Profile of Hydroxy(phenyl)methanesulfonic acid
Property Insights of Hydroxy(phenyl)methanesulfonic acid
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hydroxy(phenyl)methanesulfonic acid. The TPSA of 83.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Hydroxy(phenyl)methanesulfonic acid. Following Lipinski's Rule of Five, Hydroxy(phenyl)methanesulfonic acid has 2 hydrogen bond donor(s) and 4 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 Hydroxy(phenyl)methanesulfonic acid?
The CAS number of Hydroxy(phenyl)methanesulfonic acid is 4389-41-7.
What is the molecular formula of Hydroxy(phenyl)methanesulfonic acid?
The molecular formula of Hydroxy(phenyl)methanesulfonic acid is C7H8O4S.
What is the molecular weight of Hydroxy(phenyl)methanesulfonic acid?
The molecular weight of Hydroxy(phenyl)methanesulfonic acid is 188.01 g/mol.
Where can I buy Hydroxy(phenyl)methanesulfonic acid?
You can request a quote for Hydroxy(phenyl)methanesulfonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hydroxy(phenyl)methanesulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for Hydroxy(phenyl)methanesulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.