(E)-3-(5-Methylthiophen-2-YL)acrylic acid
TL;DR: (E)-3-(5-Methylthiophen-2-YL)acrylic acid (CAS 162959-94-6) is a chemical compound with molecular formula C8H8O2S and molecular weight 168.0245 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-3-(5-methylthiophen-2-yl)prop-2-enoic acid
Also Known As: 3-(5-Methyl-2-thienyl)-2-propenoic acid, (E)-3-(5-METHYLTHIOPHEN-2-YL)ACRYLIC ACID, 3-(5-methylthiophen-2-yl)prop-2-enoic Acid, 4-(Methylthio)benzoic acid, 2-Propenoic acid, 3-(5-methyl-2-thienyl)-, (E)-
Technical Specifications
| Molecular Formula | C8H8O2S |
| Molecular Weight | 168.0245 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 65.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 168.0245 Da |
| Heavy Atoms | 11 |
| Complexity | 177.0 |
| SMILES | CC1=CC=C(S1)/C=C/C(=O)O |
| InChIKey | MHOAQQYXASUJOT-SNAWJCMRSA-N |
Chemical Property Profile of (E)-3-(5-Methylthiophen-2-YL)acrylic acid
Property Insights of (E)-3-(5-Methylthiophen-2-YL)acrylic acid
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-3-(5-Methylthiophen-2-YL)acrylic acid. The TPSA of 65.5 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-3-(5-Methylthiophen-2-YL)acrylic acid. Following Lipinski's Rule of Five, (E)-3-(5-Methylthiophen-2-YL)acrylic 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 (E)-3-(5-Methylthiophen-2-YL)acrylic acid?
The CAS number of (E)-3-(5-Methylthiophen-2-YL)acrylic acid is 162959-94-6.
What is the molecular formula of (E)-3-(5-Methylthiophen-2-YL)acrylic acid?
The molecular formula of (E)-3-(5-Methylthiophen-2-YL)acrylic acid is C8H8O2S.
What is the molecular weight of (E)-3-(5-Methylthiophen-2-YL)acrylic acid?
The molecular weight of (E)-3-(5-Methylthiophen-2-YL)acrylic acid is 168.0245 g/mol.
Where can I buy (E)-3-(5-Methylthiophen-2-YL)acrylic acid?
You can request a quote for (E)-3-(5-Methylthiophen-2-YL)acrylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (E)-3-(5-Methylthiophen-2-YL)acrylic acid?
Yes, CoreyChem provides custom synthesis services for (E)-3-(5-Methylthiophen-2-YL)acrylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.