Methyl 4-bromo-3-methoxythiophene-2-carboxylate
TL;DR: Methyl 4-bromo-3-methoxythiophene-2-carboxylate (CAS 110545-67-0) is a chemical compound with molecular formula C7H7BrO3S and molecular weight 249.92993 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 4-bromo-3-methoxythiophene-2-carboxylate
Also Known As: methyl 4-bromo-3-methoxythiophene-2-carboxylate, Maybridge1_003930, Methyl 4-bromo-3-(methyloxy)-2-thiophenecarboxylate, Methyl 4-bromo-3-methoxy-2-thiophenecarboxylate, 2-Thiophenecarboxylicacid, 4-bromo-3-methoxy-, methyl ester
Technical Specifications
| Molecular Formula | C7H7BrO3S |
| Molecular Weight | 249.92993 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 63.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 249.92993 Da |
| Heavy Atoms | 12 |
| Complexity | 176.0 |
| SMILES | COC1=C(SC=C1Br)C(=O)OC |
| InChIKey | AAUKODCGPDBXCN-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 4-bromo-3-methoxythiophene-2-carboxylate
Property Insights of Methyl 4-bromo-3-methoxythiophene-2-carboxylate
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-bromo-3-methoxythiophene-2-carboxylate. The TPSA of 63.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-bromo-3-methoxythiophene-2-carboxylate. Following Lipinski's Rule of Five, Methyl 4-bromo-3-methoxythiophene-2-carboxylate has 0 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 4-bromo-3-methoxythiophene-2-carboxylate?
The CAS number of Methyl 4-bromo-3-methoxythiophene-2-carboxylate is 110545-67-0.
What is the molecular formula of Methyl 4-bromo-3-methoxythiophene-2-carboxylate?
The molecular formula of Methyl 4-bromo-3-methoxythiophene-2-carboxylate is C7H7BrO3S.
What is the molecular weight of Methyl 4-bromo-3-methoxythiophene-2-carboxylate?
The molecular weight of Methyl 4-bromo-3-methoxythiophene-2-carboxylate is 249.92993 g/mol.
Where can I buy Methyl 4-bromo-3-methoxythiophene-2-carboxylate?
You can request a quote for Methyl 4-bromo-3-methoxythiophene-2-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 4-bromo-3-methoxythiophene-2-carboxylate?
Yes, CoreyChem provides custom synthesis services for Methyl 4-bromo-3-methoxythiophene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.