3-(3-Bromo-4,5-dimethoxyphenyl)acrylic acid
TL;DR: 3-(3-Bromo-4,5-dimethoxyphenyl)acrylic acid (CAS 151539-55-8) is a chemical compound with molecular formula C11H11BrO4 and molecular weight 285.98407 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-3-(3-bromo-4,5-dimethoxyphenyl)prop-2-enoic acid
Also Known As: 3-(3-Bromo-4,5-dimethoxyphenyl)acrylic acid, 5-Bromo-3,6-dimethyluracil, bromodimethoxyphenylacrylicacid, 4649AE, 3-(3-bromo-4,5-dimethoxyphenyl)prop-2-enoic acid
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C11H11BrO4 |
| Molecular Weight | 285.98407 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 285.98407 Da |
| Heavy Atoms | 16 |
| Complexity | 267.0 |
| SMILES | COC1=C(C(=CC(=C1)/C=C/C(=O)O)Br)OC |
| InChIKey | XPEVBCFMEHTNHN-ONEGZZNKSA-N |
Chemical Property Profile of 3-(3-Bromo-4,5-dimethoxyphenyl)acrylic acid
Property Insights of 3-(3-Bromo-4,5-dimethoxyphenyl)acrylic acid
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(3-Bromo-4,5-dimethoxyphenyl)acrylic acid. With a topological polar surface area (TPSA) of 55.8 Ų, 3-(3-Bromo-4,5-dimethoxyphenyl)acrylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3-Bromo-4,5-dimethoxyphenyl)acrylic acid has 1 hydrogen bond donor(s) and 4 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-(3-Bromo-4,5-dimethoxyphenyl)acrylic acid?
The CAS number of 3-(3-Bromo-4,5-dimethoxyphenyl)acrylic acid is 151539-55-8.
What is the molecular formula of 3-(3-Bromo-4,5-dimethoxyphenyl)acrylic acid?
The molecular formula of 3-(3-Bromo-4,5-dimethoxyphenyl)acrylic acid is C11H11BrO4.
What is the molecular weight of 3-(3-Bromo-4,5-dimethoxyphenyl)acrylic acid?
The molecular weight of 3-(3-Bromo-4,5-dimethoxyphenyl)acrylic acid is 285.98407 g/mol.
Where can I buy 3-(3-Bromo-4,5-dimethoxyphenyl)acrylic acid?
You can request a quote for 3-(3-Bromo-4,5-dimethoxyphenyl)acrylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(3-Bromo-4,5-dimethoxyphenyl)acrylic acid?
Yes, CoreyChem provides custom synthesis services for 3-(3-Bromo-4,5-dimethoxyphenyl)acrylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.