羟甲氧基苯磺酸
TL;DR: 羟甲氧基苯磺酸 (CAS 728856-24-4) is a chemical compound with molecular formula C7H8O5S and molecular weight 204.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
羟甲氧基苯磺酸
2-(hydroxymethoxy)benzenesulfonic acid
Also Known As: Thiocol, Guaiacolsulfonate, Guaiacolsulfonic acid, Hydroxymethoxybenzenesulphonic acid, 2-(hydroxymethoxy)benzenesulfonic acid
| Molecular Formula | C7H8O5S |
|---|---|
| Molecular Weight | 204.01 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 92.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 204.00925 |
| Heavy Atoms | 13 |
| Complexity | 242.0 |
Chemical Identifiers
| CAS Number | 728856-24-4 |
|---|---|
| SMILES | C1=CC=C(C(=C1)OCO)S(=O)(=O)O |
| InChIKey | GUAPLPVVNZYPSJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
羟甲氧基苯磺酸 (CAS 728856-24-4), with molecular formula C7H8O5S and molecular weight 204.01 g/mol. IUPAC: 2-(hydroxymethoxy)benzenesulfonic acid.
Chemical Property Profile of 羟甲氧基苯磺酸
Property Insights of 羟甲氧基苯磺酸
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 羟甲氧基苯磺酸. The TPSA of 92.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 羟甲氧基苯磺酸. Following Lipinski's Rule of Five, 羟甲氧基苯磺酸 has 2 hydrogen bond donor(s) and 5 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 羟甲氧基苯磺酸?
The CAS number of 羟甲氧基苯磺酸 is 728856-24-4.
What is the molecular formula of 羟甲氧基苯磺酸?
The molecular formula of 羟甲氧基苯磺酸 is C7H8O5S.
What is the molecular weight of 羟甲氧基苯磺酸?
The molecular weight of 羟甲氧基苯磺酸 is 204.01 g/mol.
Where can I buy 羟甲氧基苯磺酸?
You can request a quote for 羟甲氧基苯磺酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 羟甲氧基苯磺酸?
Yes, KEHONG BIO provides custom synthesis services for 羟甲氧基苯磺酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.