2-Methoxy-4-nitrobenzenesulfonyl chloride
TL;DR: 2-Methoxy-4-nitrobenzenesulfonyl chloride (CAS 21320-91-2) is a chemical compound with molecular formula C7H6ClNO5S and molecular weight 250.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methoxy-4-nitrobenzenesulfonyl chloride
Also Known As: 2-Methoxy-4-nitrobenzenesulfonyl chloride, 2-Methoxy-4-nitrobenzene-1-sulfonyl chloride, null, 2-methoxy-4-nitrobenzenesulfonylchloride, 2-(Chlorosulphonyl)-5-nitroanisole
| Molecular Formula | C7H6ClNO5S |
|---|---|
| Molecular Weight | 250.97 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 97.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 250.96552 |
| Heavy Atoms | 15 |
| Complexity | 332.0 |
Chemical Identifiers
| CAS Number | 21320-91-2 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)[N+](=O)[O-])S(=O)(=O)Cl |
| InChIKey | QECYXMKYZQXEHM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Methoxy-4-nitrobenzenesulfonyl chloride (CAS 21320-91-2), with molecular formula C7H6ClNO5S and molecular weight 250.97 g/mol. IUPAC: 2-methoxy-4-nitrobenzenesulfonyl chloride.
Chemical Property Profile of 2-Methoxy-4-nitrobenzenesulfonyl chloride
Property Insights of 2-Methoxy-4-nitrobenzenesulfonyl chloride
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methoxy-4-nitrobenzenesulfonyl chloride. The TPSA of 97.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methoxy-4-nitrobenzenesulfonyl chloride. Following Lipinski's Rule of Five, 2-Methoxy-4-nitrobenzenesulfonyl chloride has 0 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 2-Methoxy-4-nitrobenzenesulfonyl chloride?
The CAS number of 2-Methoxy-4-nitrobenzenesulfonyl chloride is 21320-91-2.
What is the molecular formula of 2-Methoxy-4-nitrobenzenesulfonyl chloride?
The molecular formula of 2-Methoxy-4-nitrobenzenesulfonyl chloride is C7H6ClNO5S.
What is the molecular weight of 2-Methoxy-4-nitrobenzenesulfonyl chloride?
The molecular weight of 2-Methoxy-4-nitrobenzenesulfonyl chloride is 250.97 g/mol.
Where can I buy 2-Methoxy-4-nitrobenzenesulfonyl chloride?
You can request a quote for 2-Methoxy-4-nitrobenzenesulfonyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methoxy-4-nitrobenzenesulfonyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 2-Methoxy-4-nitrobenzenesulfonyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.