Methyl 3-(thiophen-3-yl)propanoate
TL;DR: Methyl 3-(thiophen-3-yl)propanoate (CAS 179932-05-9) is a chemical compound with molecular formula C8H10O2S and molecular weight 170.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-thiophen-3-ylpropanoate
Also Known As: methyl 3-(thiophen-3-yl)propanoate, Methyl 3-thiophen-3-ylpropanoate, 3-Thiophenepropanoic acid, methyl ester, 3-thiolpropanoic acid methyl ester, methyl3-(thiophen-3-yl)propanoate
| Molecular Formula | C8H10O2S |
|---|---|
| Molecular Weight | 170.04 g/mol |
| LogP | 1.8537 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 170.04015 |
| Heavy Atoms | 11 |
| Complexity | 216.00575 |
Chemical Identifiers
| CAS Number | 179932-05-9 |
|---|---|
| SMILES | COC(=O)CCC1=CSC=C1 |
Product Overview
Methyl 3-(thiophen-3-yl)propanoate (CAS 179932-05-9), with molecular formula C8H10O2S and molecular weight 170.04 g/mol. IUPAC: methyl 3-thiophen-3-ylpropanoate.
Chemical Property Profile of Methyl 3-(thiophen-3-yl)propanoate
Property Insights of Methyl 3-(thiophen-3-yl)propanoate
The XLogP value of 1.8537 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-(thiophen-3-yl)propanoate. With a topological polar surface area (TPSA) of 26.3 Ų, Methyl 3-(thiophen-3-yl)propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3-(thiophen-3-yl)propanoate 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 3-(thiophen-3-yl)propanoate?
The CAS number of Methyl 3-(thiophen-3-yl)propanoate is 179932-05-9.
What is the molecular formula of Methyl 3-(thiophen-3-yl)propanoate?
The molecular formula of Methyl 3-(thiophen-3-yl)propanoate is C8H10O2S.
What is the molecular weight of Methyl 3-(thiophen-3-yl)propanoate?
The molecular weight of Methyl 3-(thiophen-3-yl)propanoate is 170.04 g/mol.
Where can I buy Methyl 3-(thiophen-3-yl)propanoate?
You can request a quote for Methyl 3-(thiophen-3-yl)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-(thiophen-3-yl)propanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-(thiophen-3-yl)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.