Methyl 5-methyl-2-thiophenecarboxylate
TL;DR: Methyl 5-methyl-2-thiophenecarboxylate (CAS 19532-75-3) 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 5-methylthiophene-2-carboxylate
Also Known As: methyl 5-methylthiophene-2-carboxylate, Methyl 5-methyl-2-thiophenecarboxylate, RARECHEM AL BF 0181, 2-Thiophenecarboxylic acid, 5-methyl-, methyl ester, Methyl5-methylthiophene-2-carboxylate
| Molecular Formula | C7H8O2S |
|---|---|
| Molecular Weight | 156.02 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 54.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 156.0245 |
| Heavy Atoms | 10 |
| Complexity | 136.0 |
Chemical Identifiers
| CAS Number | 19532-75-3 |
|---|---|
| SMILES | CC1=CC=C(S1)C(=O)OC |
| InChIKey | NEPZGUGQLAOODR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl 5-methyl-2-thiophenecarboxylate (CAS 19532-75-3), with molecular formula C7H8O2S and molecular weight 156.02 g/mol. IUPAC: methyl 5-methylthiophene-2-carboxylate.
Chemical Property Profile of Methyl 5-methyl-2-thiophenecarboxylate
Property Insights of Methyl 5-methyl-2-thiophenecarboxylate
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 5-methyl-2-thiophenecarboxylate. With a topological polar surface area (TPSA) of 54.5 Ų, Methyl 5-methyl-2-thiophenecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 5-methyl-2-thiophenecarboxylate 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 5-methyl-2-thiophenecarboxylate?
The CAS number of Methyl 5-methyl-2-thiophenecarboxylate is 19532-75-3.
What is the molecular formula of Methyl 5-methyl-2-thiophenecarboxylate?
The molecular formula of Methyl 5-methyl-2-thiophenecarboxylate is C7H8O2S.
What is the molecular weight of Methyl 5-methyl-2-thiophenecarboxylate?
The molecular weight of Methyl 5-methyl-2-thiophenecarboxylate is 156.02 g/mol.
Where can I buy Methyl 5-methyl-2-thiophenecarboxylate?
You can request a quote for Methyl 5-methyl-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-methyl-2-thiophenecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 5-methyl-2-thiophenecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.