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 246.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
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
| Molecular Formula | C13H10O3S |
|---|---|
| Molecular Weight | 246.04 g/mol |
| LogP | 3.0142 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 246.03506 |
| Heavy Atoms | 17 |
| Complexity | 557.2971 |
Chemical Identifiers
| CAS Number | 1024449-31-7 |
|---|---|
| SMILES | COC(=O)C1=CC=C(S1)C2=CC=CC(=C2)C=O |
Product Overview
Methyl 5-(3-formylphenyl)-2-thiophenecarboxylate (CAS 1024449-31-7), with molecular formula C13H10O3S and molecular weight 246.04 g/mol. IUPAC: methyl 5-(3-formylphenyl)thiophene-2-carboxylate.
Chemical Property Profile of Methyl 5-(3-formylphenyl)-2-thiophenecarboxylate
Property Insights of Methyl 5-(3-formylphenyl)-2-thiophenecarboxylate
The XLogP value of 3.0142 indicates that Methyl 5-(3-formylphenyl)-2-thiophenecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.37 Ų, Methyl 5-(3-formylphenyl)-2-thiophenecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. 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
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 246.04 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 KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 5-(3-formylphenyl)-2-thiophenecarboxylate?
Yes, KEHONG BIO 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.