ABTS
TL;DR: ABTS (CAS 30931-67-0) is a chemical compound with molecular formula C18H24N6O6S4 and molecular weight 548.064 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
diazanium;3-ethyl-2-[(3-ethyl-6-sulfonato-1,3-benzothiazol-2-ylidene)hydrazinylidene]-1,3-benzothiazole-6-sulfonate
Also Known As: ABTS, ABTS diammonium salt, ABTS Diammonium, Diammonium 2,2'-azino-bis(3-ethylbenzothiazoline-6-sulfonate), W-202279
Application Areas
Top 5 of 14 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C18H24N6O6S4 |
| Molecular Weight | 548.064 g/mol |
| XLogP | 2.74 |
| Topological Polar Surface Area (TPSA) | 215.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 3 |
| Exact Mass | 548.064 Da |
| Heavy Atoms | 34 |
| Complexity | 883.0 |
| SMILES | CCN1C2=C(C=C(C=C2)S(=O)(=O)[O-])SC1=NN=C3N(C4=C(S3)C=C(C=C4)S(=O)(=O)[O-])CC.[NH4+].[NH4+] |
| InChIKey | OHDRQQURAXLVGJ-UHFFFAOYSA-N |
Chemical Property Profile of ABTS
Property Insights of ABTS
The XLogP value of 2.74 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ABTS. The TPSA of 215.0 Ų indicates high polarity, suggesting ABTS may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, ABTS has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of ABTS?
The CAS number of ABTS is 30931-67-0.
What is the molecular formula of ABTS?
The molecular formula of ABTS is C18H24N6O6S4.
What is the molecular weight of ABTS?
The molecular weight of ABTS is 548.064 g/mol.
Where can I buy ABTS?
You can request a quote for ABTS directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for ABTS?
Yes, CoreyChem provides custom synthesis services for ABTS and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.