Sulfo-1-triazol
TL;DR: Sulfo-1-triazol (CAS 74039-02-4) is a chemical compound with molecular formula C22H13K3N4O9S3 and molecular weight 689.8756 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tripotassium;2-[4-(4-amino-3-sulfonatophenyl)phenyl]benzo[e]benzotriazole-6,8-disulfonate
Also Known As: Sulfo-1-triazol, Sulfo-1-triazol [Czech], 2H-Naphtho(1,2-d)triazole-6,8-disulfonic acid, 2-(4'-amino-3'-sulfo-1,1'-biphenyl-4-yl)-, tripotassium salt, 2-(4'-Aminoxenyl)nafto-alpha,beta-triazol-6,8,3'-trisulfonan draselny [Czech], 2-(4'-Aminoxenyl)nafto-alpha,beta-triazol-6,8,3'-trisulfonan draselny
Technical Specifications
| Molecular Formula | C22H13K3N4O9S3 |
| Molecular Weight | 689.8756 g/mol |
| XLogP | -7.45 |
| Topological Polar Surface Area (TPSA) | 253.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 2 |
| Exact Mass | 689.8756 Da |
| Heavy Atoms | 41 |
| Complexity | 1150.0 |
| SMILES | C1=CC(=CC=C1C2=CC(=C(C=C2)N)S(=O)(=O)[O-])N3N=C4C=CC5=C(C4=N3)C=C(C=C5S(=O)(=O)[O-])S(=O)(=O)[O-].[K+].[K+].[K+] |
| InChIKey | ATBGUFDAYYBFEQ-UHFFFAOYSA-K |
Chemical Property Profile of Sulfo-1-triazol
Property Insights of Sulfo-1-triazol
The XLogP value of -7.45 indicates that Sulfo-1-triazol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 253.0 Ų indicates high polarity, suggesting Sulfo-1-triazol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Sulfo-1-triazol has 1 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Sulfo-1-triazol?
The CAS number of Sulfo-1-triazol is 74039-02-4.
What is the molecular formula of Sulfo-1-triazol?
The molecular formula of Sulfo-1-triazol is C22H13K3N4O9S3.
What is the molecular weight of Sulfo-1-triazol?
The molecular weight of Sulfo-1-triazol is 689.8756 g/mol.
Where can I buy Sulfo-1-triazol?
You can request a quote for Sulfo-1-triazol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Sulfo-1-triazol?
Yes, CoreyChem provides custom synthesis services for Sulfo-1-triazol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.