Methyl 4-methylthiophene-2-carboxylate
TL;DR: Methyl 4-methylthiophene-2-carboxylate (CAS 28686-90-0) is a chemical compound with molecular formula C7H8O2S and molecular weight 156.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-methylthiophene-2-carboxylate
Also Known As: methyl 4-methylthiophene-2-carboxylate, Methyl 4-methyl-2-thenoate, 2-Thiophenecarboxylic acid, 4-methyl-, methyl ester, Methyl 4-Methyl-thiophene-2-carboxylate, 3-(2-Pyridyldithio)propanoic acid
| Molecular Formula | C7H8O2S |
|---|---|
| Molecular Weight | 156.02 g/mol |
| LogP | 1.84312 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 156.0245 |
| Heavy Atoms | 10 |
| Complexity | 239.50908 |
Chemical Identifiers
| CAS Number | 28686-90-0 |
|---|---|
| SMILES | CC1=CSC(=C1)C(=O)OC |
Product Overview
Methyl 4-methylthiophene-2-carboxylate (CAS 28686-90-0), with molecular formula C7H8O2S and molecular weight 156.02 g/mol. IUPAC: methyl 4-methylthiophene-2-carboxylate.
Chemical Property Profile of Methyl 4-methylthiophene-2-carboxylate
Property Insights of Methyl 4-methylthiophene-2-carboxylate
The XLogP value of 1.84312 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-methylthiophene-2-carboxylate. With a topological polar surface area (TPSA) of 26.3 Ų, Methyl 4-methylthiophene-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 4-methylthiophene-2-carboxylate has 0 hydrogen bond donor(s) and 3 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 4-methylthiophene-2-carboxylate?
The CAS number of Methyl 4-methylthiophene-2-carboxylate is 28686-90-0.
What is the molecular formula of Methyl 4-methylthiophene-2-carboxylate?
The molecular formula of Methyl 4-methylthiophene-2-carboxylate is C7H8O2S.
What is the molecular weight of Methyl 4-methylthiophene-2-carboxylate?
The molecular weight of Methyl 4-methylthiophene-2-carboxylate is 156.02 g/mol.
Where can I buy Methyl 4-methylthiophene-2-carboxylate?
You can request a quote for Methyl 4-methylthiophene-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-methylthiophene-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-methylthiophene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.