3-(4-Bromothiophen-2-yl)acrylic acid
TL;DR: 3-(4-Bromothiophen-2-yl)acrylic acid (CAS 103686-16-4) is a chemical compound with molecular formula C7H5BrO2S and molecular weight 231.91936 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(4-bromothiophen-2-yl)prop-2-enoic acid
Also Known As: 3-(4-bromothiophen-2-yl)acrylic acid, 3-(4-bromo-2-thienyl)acrylic acid, 3-(4-bromothiophen-2-yl)prop-2-enoic Acid, 2-Propenoic acid,3-(4-bromo-2-thienyl)-, 3-(4-Bromo-thiophen-2-yl)-acrylic acid
Technical Specifications
| Molecular Formula | C7H5BrO2S |
| Molecular Weight | 231.91936 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 65.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 231.91936 Da |
| Heavy Atoms | 11 |
| Complexity | 181.0 |
| SMILES | C1=C(SC=C1Br)C=CC(=O)O |
| InChIKey | VHKFUECAKTYKCR-UHFFFAOYSA-N |
Chemical Property Profile of 3-(4-Bromothiophen-2-yl)acrylic acid
Property Insights of 3-(4-Bromothiophen-2-yl)acrylic acid
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Bromothiophen-2-yl)acrylic acid. The TPSA of 65.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-Bromothiophen-2-yl)acrylic acid. Following Lipinski's Rule of Five, 3-(4-Bromothiophen-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 3-(4-Bromothiophen-2-yl)acrylic acid?
The CAS number of 3-(4-Bromothiophen-2-yl)acrylic acid is 103686-16-4.
What is the molecular formula of 3-(4-Bromothiophen-2-yl)acrylic acid?
The molecular formula of 3-(4-Bromothiophen-2-yl)acrylic acid is C7H5BrO2S.
What is the molecular weight of 3-(4-Bromothiophen-2-yl)acrylic acid?
The molecular weight of 3-(4-Bromothiophen-2-yl)acrylic acid is 231.91936 g/mol.
Where can I buy 3-(4-Bromothiophen-2-yl)acrylic acid?
You can request a quote for 3-(4-Bromothiophen-2-yl)acrylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(4-Bromothiophen-2-yl)acrylic acid?
Yes, CoreyChem provides custom synthesis services for 3-(4-Bromothiophen-2-yl)acrylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.