Methyl 3-(3-methyl-2-thienyl)acrylate
TL;DR: Methyl 3-(3-methyl-2-thienyl)acrylate (CAS 91150-48-0) is a chemical compound with molecular formula C9H10O2S and molecular weight 182.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (E)-3-(3-methylthiophen-2-yl)prop-2-enoate
Also Known As: METHYL3- ACRYLATE, methyl 3-(3-methyl-2-thienyl)acrylate, Methyl 3-(3-methylthiophen-2-yl)prop-2-enoate, J1.428.438I, METHYL (2E)-3-(3-METHYLTHIOPHEN-2-YL)PROP-2-ENOATE
| Molecular Formula | C9H10O2S |
|---|---|
| Molecular Weight | 182.04 g/mol |
| LogP | 2.24272 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 182.04015 |
| Heavy Atoms | 12 |
| Complexity | 299.23212 |
Chemical Identifiers
| CAS Number | 91150-48-0 |
|---|---|
| SMILES | CC1=C(SC=C1)/C=C/C(=O)OC |
Product Overview
Methyl 3-(3-methyl-2-thienyl)acrylate (CAS 91150-48-0), with molecular formula C9H10O2S and molecular weight 182.04 g/mol. IUPAC: methyl (E)-3-(3-methylthiophen-2-yl)prop-2-enoate.
Chemical Property Profile of Methyl 3-(3-methyl-2-thienyl)acrylate
Property Insights of Methyl 3-(3-methyl-2-thienyl)acrylate
The XLogP value of 2.24272 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-(3-methyl-2-thienyl)acrylate. With a topological polar surface area (TPSA) of 26.3 Ų, Methyl 3-(3-methyl-2-thienyl)acrylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3-(3-methyl-2-thienyl)acrylate 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-(3-methyl-2-thienyl)acrylate?
The CAS number of Methyl 3-(3-methyl-2-thienyl)acrylate is 91150-48-0.
What is the molecular formula of Methyl 3-(3-methyl-2-thienyl)acrylate?
The molecular formula of Methyl 3-(3-methyl-2-thienyl)acrylate is C9H10O2S.
What is the molecular weight of Methyl 3-(3-methyl-2-thienyl)acrylate?
The molecular weight of Methyl 3-(3-methyl-2-thienyl)acrylate is 182.04 g/mol.
Where can I buy Methyl 3-(3-methyl-2-thienyl)acrylate?
You can request a quote for Methyl 3-(3-methyl-2-thienyl)acrylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-(3-methyl-2-thienyl)acrylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-(3-methyl-2-thienyl)acrylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.