4-(2-Chloro-6-nitrophenoxy)benzene-1-sulfonyl chloride
TL;DR: 4-(2-Chloro-6-nitrophenoxy)benzene-1-sulfonyl chloride (CAS 175135-00-9) is a chemical compound with molecular formula C12H7Cl2NO5S and molecular weight 346.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-chloro-6-nitrophenoxy)benzenesulfonyl chloride
Also Known As: 4-(2-Chloro-6-nitrophenoxy)benzene-1-sulfonyl chloride, 4-(2-chloro-6-nitrophenoxy)benzenesulfonyl chloride, BUTTPARK 96\12-92, 4-(2-chloro-6-nitrophenoxy)benzene-1-sulphonyl chloride, Benzenesulfonyl chloride, 4-(2-chloro-6-nitrophenoxy)-
| Molecular Formula | C12H7Cl2NO5S |
|---|---|
| Molecular Weight | 346.94 g/mol |
| LogP | 3.968 |
| Topological Polar Surface Area | 86.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 346.9422 |
| Heavy Atoms | 21 |
| Complexity | 789.7951 |
Chemical Identifiers
| CAS Number | 175135-00-9 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)Cl)OC2=CC=C(C=C2)S(=O)(=O)Cl)[N+](=O)[O-] |
Product Overview
4-(2-Chloro-6-nitrophenoxy)benzene-1-sulfonyl chloride (CAS 175135-00-9), with molecular formula C12H7Cl2NO5S and molecular weight 346.94 g/mol. IUPAC: 4-(2-chloro-6-nitrophenoxy)benzenesulfonyl chloride.
Chemical Property Profile of 4-(2-Chloro-6-nitrophenoxy)benzene-1-sulfonyl chloride
Property Insights of 4-(2-Chloro-6-nitrophenoxy)benzene-1-sulfonyl chloride
The XLogP value of 3.968 indicates that 4-(2-Chloro-6-nitrophenoxy)benzene-1-sulfonyl chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.51 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-Chloro-6-nitrophenoxy)benzene-1-sulfonyl chloride. Following Lipinski's Rule of Five, 4-(2-Chloro-6-nitrophenoxy)benzene-1-sulfonyl 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 4-(2-Chloro-6-nitrophenoxy)benzene-1-sulfonyl chloride?
The CAS number of 4-(2-Chloro-6-nitrophenoxy)benzene-1-sulfonyl chloride is 175135-00-9.
What is the molecular formula of 4-(2-Chloro-6-nitrophenoxy)benzene-1-sulfonyl chloride?
The molecular formula of 4-(2-Chloro-6-nitrophenoxy)benzene-1-sulfonyl chloride is C12H7Cl2NO5S.
What is the molecular weight of 4-(2-Chloro-6-nitrophenoxy)benzene-1-sulfonyl chloride?
The molecular weight of 4-(2-Chloro-6-nitrophenoxy)benzene-1-sulfonyl chloride is 346.94 g/mol.
Where can I buy 4-(2-Chloro-6-nitrophenoxy)benzene-1-sulfonyl chloride?
You can request a quote for 4-(2-Chloro-6-nitrophenoxy)benzene-1-sulfonyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-Chloro-6-nitrophenoxy)benzene-1-sulfonyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-Chloro-6-nitrophenoxy)benzene-1-sulfonyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.