![2-[(4-Methoxy-3-nitrophenyl)sulfonyl]ethanol structure](/static/products/5239/52398-83-1.webp)
2-[(4-Methoxy-3-nitrophenyl)sulfonyl]ethanol
TL;DR: 2-[(4-Methoxy-3-nitrophenyl)sulfonyl]ethanol (CAS 52398-83-1) is a chemical compound with molecular formula C9H11NO6S and molecular weight 261.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methoxy-3-nitrophenyl)sulfonylethanol
Also Known As: 2-(4-methoxy-3-nitrophenyl)sulfonylethanol, 2-[(4-methoxy-3-nitrophenyl)sulfonyl]ethanol, Ethanol, 2-[(4-methoxy-3-nitrophenyl)sulfonyl]-, 2-((4-Methoxy-3-nitrophenyl)sulfonyl)ethanol, 2-((4-Methoxy-3-nitrophenyl)sulphonyl)ethanol
| Molecular Formula | C9H11NO6S |
|---|---|
| Molecular Weight | 261.03 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 118.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 261.0307 |
| Heavy Atoms | 17 |
| Complexity | 357.0 |
Chemical Identifiers
| CAS Number | 52398-83-1 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)S(=O)(=O)CCO)[N+](=O)[O-] |
| InChIKey | XIPJCKZGPTYNFJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-[(4-Methoxy-3-nitrophenyl)sulfonyl]ethanol (CAS 52398-83-1), with molecular formula C9H11NO6S and molecular weight 261.03 g/mol. IUPAC: 2-(4-methoxy-3-nitrophenyl)sulfonylethanol.
Chemical Property Profile of 2-[(4-Methoxy-3-nitrophenyl)sulfonyl]ethanol
Property Insights of 2-[(4-Methoxy-3-nitrophenyl)sulfonyl]ethanol
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(4-Methoxy-3-nitrophenyl)sulfonyl]ethanol. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(4-Methoxy-3-nitrophenyl)sulfonyl]ethanol. Following Lipinski's Rule of Five, 2-[(4-Methoxy-3-nitrophenyl)sulfonyl]ethanol has 1 hydrogen bond donor(s) and 6 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 2-[(4-Methoxy-3-nitrophenyl)sulfonyl]ethanol?
The CAS number of 2-[(4-Methoxy-3-nitrophenyl)sulfonyl]ethanol is 52398-83-1.
What is the molecular formula of 2-[(4-Methoxy-3-nitrophenyl)sulfonyl]ethanol?
The molecular formula of 2-[(4-Methoxy-3-nitrophenyl)sulfonyl]ethanol is C9H11NO6S.
What is the molecular weight of 2-[(4-Methoxy-3-nitrophenyl)sulfonyl]ethanol?
The molecular weight of 2-[(4-Methoxy-3-nitrophenyl)sulfonyl]ethanol is 261.03 g/mol.
Where can I buy 2-[(4-Methoxy-3-nitrophenyl)sulfonyl]ethanol?
You can request a quote for 2-[(4-Methoxy-3-nitrophenyl)sulfonyl]ethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(4-Methoxy-3-nitrophenyl)sulfonyl]ethanol?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-Methoxy-3-nitrophenyl)sulfonyl]ethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.