Dimethyl 4-aminothiophene-2,3-dicarboxylate
TL;DR: Dimethyl 4-aminothiophene-2,3-dicarboxylate (CAS 121071-71-4) is a chemical compound with molecular formula C8H9NO4S and molecular weight 215.02522 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dimethyl 4-aminothiophene-2,3-dicarboxylate
Also Known As: Dimethyl 4-aminothiophene-2,3-dicarboxylate, Maybridge1_003840, 2,3-dimethyl 4-aminothiophene-2,3-dicarboxylate, 4-Amino-thiophene-2,3-dicarboxylic acid dimethyl ester, BUTTPARK 154\18-53
Technical Specifications
| Molecular Formula | C8H9NO4S |
| Molecular Weight | 215.02522 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 107.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 215.02522 Da |
| Heavy Atoms | 14 |
| Complexity | 245.0 |
| SMILES | COC(=O)C1=C(SC=C1N)C(=O)OC |
| InChIKey | XQPDCUCAKYNVAO-UHFFFAOYSA-N |
Chemical Property Profile of Dimethyl 4-aminothiophene-2,3-dicarboxylate
Property Insights of Dimethyl 4-aminothiophene-2,3-dicarboxylate
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl 4-aminothiophene-2,3-dicarboxylate. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl 4-aminothiophene-2,3-dicarboxylate. Following Lipinski's Rule of Five, Dimethyl 4-aminothiophene-2,3-dicarboxylate has 1 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 Dimethyl 4-aminothiophene-2,3-dicarboxylate?
The CAS number of Dimethyl 4-aminothiophene-2,3-dicarboxylate is 121071-71-4.
What is the molecular formula of Dimethyl 4-aminothiophene-2,3-dicarboxylate?
The molecular formula of Dimethyl 4-aminothiophene-2,3-dicarboxylate is C8H9NO4S.
What is the molecular weight of Dimethyl 4-aminothiophene-2,3-dicarboxylate?
The molecular weight of Dimethyl 4-aminothiophene-2,3-dicarboxylate is 215.02522 g/mol.
Where can I buy Dimethyl 4-aminothiophene-2,3-dicarboxylate?
You can request a quote for Dimethyl 4-aminothiophene-2,3-dicarboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Dimethyl 4-aminothiophene-2,3-dicarboxylate?
Yes, CoreyChem provides custom synthesis services for Dimethyl 4-aminothiophene-2,3-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.