Methyl 5-(3-formylphenyl)-2-thiophenecarboxylate
TL;DR: Methyl 5-(3-formylphenyl)-2-thiophenecarboxylate (CAS 1024449-31-7) is a chemical compound with molecular formula C13H10O3S and molecular weight 246.03506 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 5-(3-formylphenyl)thiophene-2-carboxylate
Also Known As: Methyl 5-(3-formylphenyl)thiophene-2-carboxylate, Methyl 5-(3-formylphenyl)-2-thiophenecarboxylate, 2-Thiophenecarboxylic acid, 5-(3-formylphenyl)-, methyl ester
Technical Specifications
| Molecular Formula | C13H10O3S |
| Molecular Weight | 246.03506 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 71.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 246.03506 Da |
| Heavy Atoms | 17 |
| Complexity | 292.0 |
| SMILES | COC(=O)C1=CC=C(S1)C2=CC=CC(=C2)C=O |
| InChIKey | WIDCRBBXZRNFOQ-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 5-(3-formylphenyl)-2-thiophenecarboxylate
Property Insights of Methyl 5-(3-formylphenyl)-2-thiophenecarboxylate
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 5-(3-formylphenyl)-2-thiophenecarboxylate. The TPSA of 71.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 5-(3-formylphenyl)-2-thiophenecarboxylate. Following Lipinski's Rule of Five, Methyl 5-(3-formylphenyl)-2-thiophenecarboxylate 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 5-(3-formylphenyl)-2-thiophenecarboxylate?
The CAS number of Methyl 5-(3-formylphenyl)-2-thiophenecarboxylate is 1024449-31-7.
What is the molecular formula of Methyl 5-(3-formylphenyl)-2-thiophenecarboxylate?
The molecular formula of Methyl 5-(3-formylphenyl)-2-thiophenecarboxylate is C13H10O3S.
What is the molecular weight of Methyl 5-(3-formylphenyl)-2-thiophenecarboxylate?
The molecular weight of Methyl 5-(3-formylphenyl)-2-thiophenecarboxylate is 246.03506 g/mol.
Where can I buy Methyl 5-(3-formylphenyl)-2-thiophenecarboxylate?
You can request a quote for Methyl 5-(3-formylphenyl)-2-thiophenecarboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 5-(3-formylphenyl)-2-thiophenecarboxylate?
Yes, CoreyChem provides custom synthesis services for Methyl 5-(3-formylphenyl)-2-thiophenecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.