Methyl 5-amino-2-thiophenecarboxylate
TL;DR: Methyl 5-amino-2-thiophenecarboxylate (CAS 14597-58-1) is a chemical compound with molecular formula C6H7NO2S and molecular weight 157.01974 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 5-aminothiophene-2-carboxylate
Also Known As: Methyl 5-aminothiophene-2-carboxylate, 5-Amino-thiophene-2-carboxylic acid methyl ester, 2-Thiophenecarboxylic acid, 5-amino-, methyl ester, Methyl 5-amino-2-thiophenecarboxylate, 5-Aminothiophene-2-carboxylic acid methyl ester
Technical Specifications
| Molecular Formula | C6H7NO2S |
| Molecular Weight | 157.01974 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 80.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 157.01974 Da |
| Heavy Atoms | 10 |
| Complexity | 140.0 |
| SMILES | COC(=O)C1=CC=C(S1)N |
| InChIKey | NNQTUMGJWXJMIR-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 5-amino-2-thiophenecarboxylate
Property Insights of Methyl 5-amino-2-thiophenecarboxylate
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 5-amino-2-thiophenecarboxylate. The TPSA of 80.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 5-amino-2-thiophenecarboxylate. Following Lipinski's Rule of Five, Methyl 5-amino-2-thiophenecarboxylate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Methyl 5-amino-2-thiophenecarboxylate?
The CAS number of Methyl 5-amino-2-thiophenecarboxylate is 14597-58-1.
What is the molecular formula of Methyl 5-amino-2-thiophenecarboxylate?
The molecular formula of Methyl 5-amino-2-thiophenecarboxylate is C6H7NO2S.
What is the molecular weight of Methyl 5-amino-2-thiophenecarboxylate?
The molecular weight of Methyl 5-amino-2-thiophenecarboxylate is 157.01974 g/mol.
Where can I buy Methyl 5-amino-2-thiophenecarboxylate?
You can request a quote for Methyl 5-amino-2-thiophenecarboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 5-amino-2-thiophenecarboxylate?
Yes, CoreyChem provides custom synthesis services for Methyl 5-amino-2-thiophenecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.