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Phenol, 2-amino-5-[[2-(sulfooxy)ethyl]sulfonyl]-
TL;DR: Phenol, 2-amino-5-[[2-(sulfooxy)ethyl]sulfonyl]- (CAS 4726-18-5) is a chemical compound with molecular formula C8H11NO7S2 and molecular weight 297.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-amino-3-hydroxyphenyl)sulfonylethyl hydrogen sulfate
Also Known As: Phenol, 2-amino-5-((2-(sulfooxy)ethyl)sulfonyl)-, Phenol, 2-amino-5-[[2-(sulfooxy)ethyl]sulfonyl]-, J1.584.954A, 2-(4-amino-3-hydroxyphenyl)sulfonylethyl hydrogen sulfate, 1-amino-2-hydroxy-4-(2-sulfooxyethylsulfonyl)benzene
| Molecular Formula | C8H11NO7S2 |
|---|---|
| Molecular Weight | 297.00 g/mol |
| LogP | -0.9 |
| Topological Polar Surface Area | 161.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 296.99768 |
| Heavy Atoms | 18 |
| Complexity | 461.0 |
Chemical Identifiers
| CAS Number | 4726-18-5 |
|---|---|
| SMILES | C1=CC(=C(C=C1S(=O)(=O)CCOS(=O)(=O)O)O)N |
| InChIKey | UUEGEWPQEWNXGY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Phenol, 2-amino-5-[[2-(sulfooxy)ethyl]sulfonyl]- (CAS 4726-18-5), with molecular formula C8H11NO7S2 and molecular weight 297.00 g/mol. IUPAC: 2-(4-amino-3-hydroxyphenyl)sulfonylethyl hydrogen sulfate.
Chemical Property Profile of Phenol, 2-amino-5-[[2-(sulfooxy)ethyl]sulfonyl]-
Property Insights of Phenol, 2-amino-5-[[2-(sulfooxy)ethyl]sulfonyl]-
The XLogP value of -0.9 indicates that Phenol, 2-amino-5-[[2-(sulfooxy)ethyl]sulfonyl]- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 161.0 Ų indicates high polarity, suggesting Phenol, 2-amino-5-[[2-(sulfooxy)ethyl]sulfonyl]- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Phenol, 2-amino-5-[[2-(sulfooxy)ethyl]sulfonyl]- has 3 hydrogen bond donor(s) and 8 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 Phenol, 2-amino-5-[[2-(sulfooxy)ethyl]sulfonyl]-?
The CAS number of Phenol, 2-amino-5-[[2-(sulfooxy)ethyl]sulfonyl]- is 4726-18-5.
What is the molecular formula of Phenol, 2-amino-5-[[2-(sulfooxy)ethyl]sulfonyl]-?
The molecular formula of Phenol, 2-amino-5-[[2-(sulfooxy)ethyl]sulfonyl]- is C8H11NO7S2.
What is the molecular weight of Phenol, 2-amino-5-[[2-(sulfooxy)ethyl]sulfonyl]-?
The molecular weight of Phenol, 2-amino-5-[[2-(sulfooxy)ethyl]sulfonyl]- is 297.00 g/mol.
Where can I buy Phenol, 2-amino-5-[[2-(sulfooxy)ethyl]sulfonyl]-?
You can request a quote for Phenol, 2-amino-5-[[2-(sulfooxy)ethyl]sulfonyl]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenol, 2-amino-5-[[2-(sulfooxy)ethyl]sulfonyl]-?
Yes, KEHONG BIO provides custom synthesis services for Phenol, 2-amino-5-[[2-(sulfooxy)ethyl]sulfonyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.