1,3-Benzenedisulfonamide
TL;DR: 1,3-Benzenedisulfonamide (CAS 3701-01-7) is a chemical compound with molecular formula C6H8N2O4S2 and molecular weight 235.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzene-1,3-disulfonamide
Also Known As: benzene-1,3-disulfonamide, 1,3-BENZENEDISULFONAMIDE, m-Benzenedisulfonamide, benzene-1-3-disulfonamide, 2-Benzoyloxyethanethioamide
| Molecular Formula | C6H8N2O4S2 |
|---|---|
| Molecular Weight | 235.99 g/mol |
| LogP | -1.0186 |
| Topological Polar Surface Area | 120.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 235.99255 |
| Heavy Atoms | 14 |
| Complexity | 499.69916 |
Chemical Identifiers
| CAS Number | 3701-01-7 |
|---|---|
| SMILES | C1=CC(=CC(=C1)S(=O)(=O)N)S(=O)(=O)N |
Product Overview
1,3-Benzenedisulfonamide (CAS 3701-01-7), with molecular formula C6H8N2O4S2 and molecular weight 235.99 g/mol. IUPAC: benzene-1,3-disulfonamide.
Chemical Property Profile of 1,3-Benzenedisulfonamide
Property Insights of 1,3-Benzenedisulfonamide
The XLogP value of -1.0186 indicates that 1,3-Benzenedisulfonamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 120.32 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Benzenedisulfonamide. Following Lipinski's Rule of Five, 1,3-Benzenedisulfonamide has 2 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 1,3-Benzenedisulfonamide?
The CAS number of 1,3-Benzenedisulfonamide is 3701-01-7.
What is the molecular formula of 1,3-Benzenedisulfonamide?
The molecular formula of 1,3-Benzenedisulfonamide is C6H8N2O4S2.
What is the molecular weight of 1,3-Benzenedisulfonamide?
The molecular weight of 1,3-Benzenedisulfonamide is 235.99 g/mol.
Where can I buy 1,3-Benzenedisulfonamide?
You can request a quote for 1,3-Benzenedisulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Benzenedisulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Benzenedisulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.