苯酚磺酸铵
TL;DR: 苯酚磺酸铵 (CAS 130246-99-0) is a chemical compound with molecular formula C6H9NO4S and molecular weight 191.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
苯酚磺酸铵
azanium 2-hydroxybenzenesulfonate
Also Known As: Ammonium o-phenolsulfonate, Ammonium phenolsulfonate, Ammonium sulfocarbolate, Ammonium hydroxybenzenesulphonate, azanium;2-hydroxybenzenesulfonate
| Molecular Formula | C6H9NO4S |
|---|---|
| Molecular Weight | 191.03 g/mol |
| LogP | 0.6725 |
| Topological Polar Surface Area | 86.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 191.02522 |
| Heavy Atoms | 12 |
| Complexity | 202.0 |
Chemical Identifiers
| CAS Number | 130246-99-0 |
|---|---|
| SMILES | C1=CC=C(C(=C1)O)S(=O)(=O)[O-].[NH4+] |
| InChIKey | UAHUSJDFWAEKNV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
苯酚磺酸铵 (CAS 130246-99-0), with molecular formula C6H9NO4S and molecular weight 191.03 g/mol. IUPAC: azanium 2-hydroxybenzenesulfonate.
Chemical Property Profile of 苯酚磺酸铵
Property Insights of 苯酚磺酸铵
The XLogP value of 0.6725 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 苯酚磺酸铵. The TPSA of 86.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 苯酚磺酸铵. Following Lipinski's Rule of Five, 苯酚磺酸铵 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 苯酚磺酸铵?
The CAS number of 苯酚磺酸铵 is 130246-99-0.
What is the molecular formula of 苯酚磺酸铵?
The molecular formula of 苯酚磺酸铵 is C6H9NO4S.
What is the molecular weight of 苯酚磺酸铵?
The molecular weight of 苯酚磺酸铵 is 191.03 g/mol.
Where can I buy 苯酚磺酸铵?
You can request a quote for 苯酚磺酸铵 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 苯酚磺酸铵?
Yes, KEHONG BIO provides custom synthesis services for 苯酚磺酸铵 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.