Benzenesulfonic acid, 4-amino-, compd. with N-cyanoguanidine (1:1)
TL;DR: Benzenesulfonic acid, 4-amino-, compd. with N-cyanoguanidine (1:1) (CAS 68084-28-6) is a chemical compound with molecular formula C8H11N5O3S and molecular weight 257.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-aminobenzenesulfonic acid;2-cyanoguanidine
Also Known As: Cyanoguanidine, 4-aminobenzenesulfonic acid salt, 4-aminobenzenesulfonic acid-2-cyanoguanidine(1:1), 4-aminobenzenesulfonic acid; 2-cyanoguanidine, Benzenesulfonic acid, 4-amino-, compd. with cyanoguanidine (1:1), Benzenesulfonic acid, 4-amino-, compd. with N-cyanoguanidine (1:1)
| Molecular Formula | C8H11N5O3S |
|---|---|
| Molecular Weight | 257.06 g/mol |
| LogP | -0.74 |
| Topological Polar Surface Area | 177.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 257.05826 |
| Heavy Atoms | 17 |
| Complexity | 310.0 |
Chemical Identifiers
| CAS Number | 68084-28-6 |
|---|---|
| SMILES | C1=CC(=CC=C1N)S(=O)(=O)O.C(#N)N=C(N)N |
| InChIKey | XCMYMZNHQDVNAZ-UHFFFAOYSA-N |
Product Overview
Benzenesulfonic acid, 4-amino-, compd. with N-cyanoguanidine (1:1) (CAS 68084-28-6), with molecular formula C8H11N5O3S and molecular weight 257.06 g/mol. IUPAC: 4-aminobenzenesulfonic acid;2-cyanoguanidine.
Chemical Property Profile of Benzenesulfonic acid, 4-amino-, compd. with N-cyanoguanidine (1:1)
Property Insights of Benzenesulfonic acid, 4-amino-, compd. with N-cyanoguanidine (1:1)
The XLogP value of -0.74 indicates that Benzenesulfonic acid, 4-amino-, compd. with N-cyanoguanidine (1:1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 177.0 Ų indicates high polarity, suggesting Benzenesulfonic acid, 4-amino-, compd. with N-cyanoguanidine (1:1) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Benzenesulfonic acid, 4-amino-, compd. with N-cyanoguanidine (1:1) has 4 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 Benzenesulfonic acid, 4-amino-, compd. with N-cyanoguanidine (1:1)?
The CAS number of Benzenesulfonic acid, 4-amino-, compd. with N-cyanoguanidine (1:1) is 68084-28-6.
What is the molecular formula of Benzenesulfonic acid, 4-amino-, compd. with N-cyanoguanidine (1:1)?
The molecular formula of Benzenesulfonic acid, 4-amino-, compd. with N-cyanoguanidine (1:1) is C8H11N5O3S.
What is the molecular weight of Benzenesulfonic acid, 4-amino-, compd. with N-cyanoguanidine (1:1)?
The molecular weight of Benzenesulfonic acid, 4-amino-, compd. with N-cyanoguanidine (1:1) is 257.06 g/mol.
Where can I buy Benzenesulfonic acid, 4-amino-, compd. with N-cyanoguanidine (1:1)?
You can request a quote for Benzenesulfonic acid, 4-amino-, compd. with N-cyanoguanidine (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenesulfonic acid, 4-amino-, compd. with N-cyanoguanidine (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Benzenesulfonic acid, 4-amino-, compd. with N-cyanoguanidine (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.