Benzenamine, 2-(3,4-dichlorophenoxy)-5-(methylsulfonyl)-
TL;DR: Benzenamine, 2-(3,4-dichlorophenoxy)-5-(methylsulfonyl)- (CAS 83642-36-8) is a chemical compound with molecular formula C13H11Cl2NO3S and molecular weight 330.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dichlorophenoxy)-5-methylsulfonylaniline
Also Known As: Benzenamine, 2-(3,4-dichlorophenoxy)-5-(methylsulfonyl)-, 2-(3,4-dichlorophenoxy)-5-methylsulfonylaniline, 2-(3,4-dichlorophenoxy)-5-methylsulfonyl-aniline, 2-(3,4-Dichlorophenoxy)-5-(methanesulfonyl)aniline, 2-(3,4-Dichlorophenoxy)-5-(methylsulfonyl)benzenamine
| Molecular Formula | C13H11Cl2NO3S |
|---|---|
| Molecular Weight | 330.98 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 77.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 330.98367 |
| Heavy Atoms | 20 |
| Complexity | 426.0 |
Chemical Identifiers
| CAS Number | 83642-36-8 |
|---|---|
| SMILES | CS(=O)(=O)C1=CC(=C(C=C1)OC2=CC(=C(C=C2)Cl)Cl)N |
| InChIKey | JHXBPSKEYDAHNA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzenamine, 2-(3,4-dichlorophenoxy)-5-(methylsulfonyl)- (CAS 83642-36-8), with molecular formula C13H11Cl2NO3S and molecular weight 330.98 g/mol. IUPAC: 2-(3,4-dichlorophenoxy)-5-methylsulfonylaniline.
Chemical Property Profile of Benzenamine, 2-(3,4-dichlorophenoxy)-5-(methylsulfonyl)-
Property Insights of Benzenamine, 2-(3,4-dichlorophenoxy)-5-(methylsulfonyl)-
The XLogP value of 3.3 indicates that Benzenamine, 2-(3,4-dichlorophenoxy)-5-(methylsulfonyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzenamine, 2-(3,4-dichlorophenoxy)-5-(methylsulfonyl)-. Following Lipinski's Rule of Five, Benzenamine, 2-(3,4-dichlorophenoxy)-5-(methylsulfonyl)- has 1 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 Benzenamine, 2-(3,4-dichlorophenoxy)-5-(methylsulfonyl)-?
The CAS number of Benzenamine, 2-(3,4-dichlorophenoxy)-5-(methylsulfonyl)- is 83642-36-8.
What is the molecular formula of Benzenamine, 2-(3,4-dichlorophenoxy)-5-(methylsulfonyl)-?
The molecular formula of Benzenamine, 2-(3,4-dichlorophenoxy)-5-(methylsulfonyl)- is C13H11Cl2NO3S.
What is the molecular weight of Benzenamine, 2-(3,4-dichlorophenoxy)-5-(methylsulfonyl)-?
The molecular weight of Benzenamine, 2-(3,4-dichlorophenoxy)-5-(methylsulfonyl)- is 330.98 g/mol.
Where can I buy Benzenamine, 2-(3,4-dichlorophenoxy)-5-(methylsulfonyl)-?
You can request a quote for Benzenamine, 2-(3,4-dichlorophenoxy)-5-(methylsulfonyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenamine, 2-(3,4-dichlorophenoxy)-5-(methylsulfonyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzenamine, 2-(3,4-dichlorophenoxy)-5-(methylsulfonyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.