1,3,5-Trithiane-2,4,6-tricarboxylic acid
TL;DR: 1,3,5-Trithiane-2,4,6-tricarboxylic acid (CAS 68928-51-8) is a chemical compound with molecular formula C6H6O6S3 and molecular weight 269.93265 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,3,5-trithiane-2,4,6-tricarboxylic acid
Also Known As: 1,3,5-Trithiane-2,4,6-tricarboxylic acid, 2,4,6-Tricarboxy-1,3,5-trithiane, KST-1B7898, 1,3,5-Trithiane-2,4,6-tricarboxylicacid, 273-020-2
Technical Specifications
| Molecular Formula | C6H6O6S3 |
| Molecular Weight | 269.93265 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 188.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 269.93265 Da |
| Heavy Atoms | 15 |
| Complexity | 246.0 |
| SMILES | C1(SC(SC(S1)C(=O)O)C(=O)O)C(=O)O |
| InChIKey | VZFJMKRFMNCZSK-UHFFFAOYSA-N |
Chemical Property Profile of 1,3,5-Trithiane-2,4,6-tricarboxylic acid
Property Insights of 1,3,5-Trithiane-2,4,6-tricarboxylic acid
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3,5-Trithiane-2,4,6-tricarboxylic acid. The TPSA of 188.0 Ų indicates high polarity, suggesting 1,3,5-Trithiane-2,4,6-tricarboxylic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,3,5-Trithiane-2,4,6-tricarboxylic acid has 3 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1,3,5-Trithiane-2,4,6-tricarboxylic acid?
The CAS number of 1,3,5-Trithiane-2,4,6-tricarboxylic acid is 68928-51-8.
What is the molecular formula of 1,3,5-Trithiane-2,4,6-tricarboxylic acid?
The molecular formula of 1,3,5-Trithiane-2,4,6-tricarboxylic acid is C6H6O6S3.
What is the molecular weight of 1,3,5-Trithiane-2,4,6-tricarboxylic acid?
The molecular weight of 1,3,5-Trithiane-2,4,6-tricarboxylic acid is 269.93265 g/mol.
Where can I buy 1,3,5-Trithiane-2,4,6-tricarboxylic acid?
You can request a quote for 1,3,5-Trithiane-2,4,6-tricarboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,3,5-Trithiane-2,4,6-tricarboxylic acid?
Yes, CoreyChem provides custom synthesis services for 1,3,5-Trithiane-2,4,6-tricarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.