2-Thiophenecarboxylic acid, 4-hydroxy-5-methyl-, ethyl ester
TL;DR: 2-Thiophenecarboxylic acid, 4-hydroxy-5-methyl-, ethyl ester (CAS 5556-09-2) is a chemical compound with molecular formula C8H10O3S and molecular weight 186.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-hydroxy-5-methylthiophene-2-carboxylate
Also Known As: ethyl 4-hydroxy-5-methylthiophene-2-carboxylate, Ethyl 4-hydroxy-5-methyl-2-thiophenecarboxylate, Ethyl 4-hydroxy-5-methyl-2-thiophenecarboxylate #, 4-Hydroxy-5-methyl-2-thiophenecarboxylicacidethylester, 4-Hydroxy-5-methyl-2-thiophenecarboxylic acid ethyl ester
| Molecular Formula | C8H10O3S |
|---|---|
| Molecular Weight | 186.04 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 74.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 186.03506 |
| Heavy Atoms | 12 |
| Complexity | 172.0 |
Chemical Identifiers
| CAS Number | 5556-09-2 |
|---|---|
| SMILES | CCOC(=O)C1=CC(=C(S1)C)O |
| InChIKey | VRPWBDLBYGEORM-UHFFFAOYSA-N |
Product Overview
2-Thiophenecarboxylic acid, 4-hydroxy-5-methyl-, ethyl ester (CAS 5556-09-2), with molecular formula C8H10O3S and molecular weight 186.04 g/mol. IUPAC: ethyl 4-hydroxy-5-methylthiophene-2-carboxylate.
Chemical Property Profile of 2-Thiophenecarboxylic acid, 4-hydroxy-5-methyl-, ethyl ester
Property Insights of 2-Thiophenecarboxylic acid, 4-hydroxy-5-methyl-, ethyl ester
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Thiophenecarboxylic acid, 4-hydroxy-5-methyl-, ethyl ester. The TPSA of 74.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Thiophenecarboxylic acid, 4-hydroxy-5-methyl-, ethyl ester. Following Lipinski's Rule of Five, 2-Thiophenecarboxylic acid, 4-hydroxy-5-methyl-, ethyl ester has 1 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 2-Thiophenecarboxylic acid, 4-hydroxy-5-methyl-, ethyl ester?
The CAS number of 2-Thiophenecarboxylic acid, 4-hydroxy-5-methyl-, ethyl ester is 5556-09-2.
What is the molecular formula of 2-Thiophenecarboxylic acid, 4-hydroxy-5-methyl-, ethyl ester?
The molecular formula of 2-Thiophenecarboxylic acid, 4-hydroxy-5-methyl-, ethyl ester is C8H10O3S.
What is the molecular weight of 2-Thiophenecarboxylic acid, 4-hydroxy-5-methyl-, ethyl ester?
The molecular weight of 2-Thiophenecarboxylic acid, 4-hydroxy-5-methyl-, ethyl ester is 186.04 g/mol.
Where can I buy 2-Thiophenecarboxylic acid, 4-hydroxy-5-methyl-, ethyl ester?
You can request a quote for 2-Thiophenecarboxylic acid, 4-hydroxy-5-methyl-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Thiophenecarboxylic acid, 4-hydroxy-5-methyl-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2-Thiophenecarboxylic acid, 4-hydroxy-5-methyl-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.