2-Methyl-1,3-benzothiazole-5,6-dicarboxylic acid
TL;DR: 2-Methyl-1,3-benzothiazole-5,6-dicarboxylic acid (CAS 346712-17-2) is a chemical compound with molecular formula C10H7NO4S and molecular weight 237.00958 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-methyl-1,3-benzothiazole-5,6-dicarboxylic acid
Also Known As: 2-methyl-1,3-benzothiazole-5,6-dicarboxylic acid, 2-methylbenzothiazole-5,6-dicarboxylic Acid
Technical Specifications
| Molecular Formula | C10H7NO4S |
| Molecular Weight | 237.00958 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 116.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 237.00958 Da |
| Heavy Atoms | 16 |
| Complexity | 322.0 |
| SMILES | CC1=NC2=C(S1)C=C(C(=C2)C(=O)O)C(=O)O |
| InChIKey | AKWZJSDZVFSBOW-UHFFFAOYSA-N |
Product Description
Applications: 2-Methyl-1,3-benzothiazole-5,6-dicarboxylic acid is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
2-Methyl-1,3-benzothiazole-5,6-dicarboxylic acid (CAS 346712-17-2) is a fine chemical with the molecular formula C10H7NO4S and a molecular weight of 237.01 g/mol. Synonyms include 2-methyl-1,3-benzothiazole-5,6-dicarboxylic acid and 2-methylbenzothiazole-5,6-dicarboxylic Acid.
Custom synthesis (mg to ton scale), HPLC/NMR/MS analytical support, and complete COA/MSDS documentation are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 2-Methyl-1,3-benzothiazole-5,6-dicarboxylic acid
Property Insights of 2-Methyl-1,3-benzothiazole-5,6-dicarboxylic acid
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-1,3-benzothiazole-5,6-dicarboxylic acid. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methyl-1,3-benzothiazole-5,6-dicarboxylic acid. Following Lipinski's Rule of Five, 2-Methyl-1,3-benzothiazole-5,6-dicarboxylic acid has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Methyl-1,3-benzothiazole-5,6-dicarboxylic acid?
The CAS number of 2-Methyl-1,3-benzothiazole-5,6-dicarboxylic acid is 346712-17-2.
What is the molecular formula of 2-Methyl-1,3-benzothiazole-5,6-dicarboxylic acid?
The molecular formula of 2-Methyl-1,3-benzothiazole-5,6-dicarboxylic acid is C10H7NO4S.
What is the molecular weight of 2-Methyl-1,3-benzothiazole-5,6-dicarboxylic acid?
The molecular weight of 2-Methyl-1,3-benzothiazole-5,6-dicarboxylic acid is 237.00958 g/mol.
What are the applications of 2-Methyl-1,3-benzothiazole-5,6-dicarboxylic acid?
2-Methyl-1,3-benzothiazole-5,6-dicarboxylic acid is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical...
Where can I buy 2-Methyl-1,3-benzothiazole-5,6-dicarboxylic acid?
You can request a quote for 2-Methyl-1,3-benzothiazole-5,6-dicarboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Methyl-1,3-benzothiazole-5,6-dicarboxylic acid?
Yes, CoreyChem provides custom synthesis services for 2-Methyl-1,3-benzothiazole-5,6-dicarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.