(2E)-3-(3-Thienyl)-2-propenoic acid
TL;DR: (2E)-3-(3-Thienyl)-2-propenoic acid (CAS 119777-71-8) is a chemical compound with molecular formula C7H6O2S and molecular weight 154.00885 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-3-thiophen-3-ylprop-2-enoic acid
Also Known As: 3-(3-Thienyl)acrylic acid, 3-Thiopheneacrylic Acid, 3-thien-3-ylacrylic acid, 3-(thiophen-3-yl)acrylic acid, (e)-3-(thiophen-3-yl)acrylic acid
Application Areas
Top 5 of 10 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C7H6O2S |
| Molecular Weight | 154.00885 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 65.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 154.00885 Da |
| Heavy Atoms | 10 |
| Complexity | 154.0 |
| SMILES | C1=CSC=C1/C=C/C(=O)O |
| InChIKey | VYRYYUKILKRGDN-OWOJBTEDSA-N |
Chemical Property Profile of (2E)-3-(3-Thienyl)-2-propenoic acid
Property Insights of (2E)-3-(3-Thienyl)-2-propenoic acid
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2E)-3-(3-Thienyl)-2-propenoic acid. The TPSA of 65.5 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-3-(3-Thienyl)-2-propenoic acid. Following Lipinski's Rule of Five, (2E)-3-(3-Thienyl)-2-propenoic acid has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (2E)-3-(3-Thienyl)-2-propenoic acid?
The CAS number of (2E)-3-(3-Thienyl)-2-propenoic acid is 119777-71-8.
What is the molecular formula of (2E)-3-(3-Thienyl)-2-propenoic acid?
The molecular formula of (2E)-3-(3-Thienyl)-2-propenoic acid is C7H6O2S.
What is the molecular weight of (2E)-3-(3-Thienyl)-2-propenoic acid?
The molecular weight of (2E)-3-(3-Thienyl)-2-propenoic acid is 154.00885 g/mol.
Where can I buy (2E)-3-(3-Thienyl)-2-propenoic acid?
You can request a quote for (2E)-3-(3-Thienyl)-2-propenoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (2E)-3-(3-Thienyl)-2-propenoic acid?
Yes, CoreyChem provides custom synthesis services for (2E)-3-(3-Thienyl)-2-propenoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.