methyl (E)-3-(2,5-dihydroxyphenyl)acrylate
TL;DR: methyl (E)-3-(2,5-dihydroxyphenyl)acrylate (CAS 63177-57-1) is a chemical compound with molecular formula C10H10O4 and molecular weight 194.0579 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 3-(2,5-dihydroxyphenyl)prop-2-enoate
Also Known As: erbstatin analog, Methyl 2,5-dihydroxycinnamate, Sodium 4-aminosalicylate, methyl 3-(2,5-dihydroxyphenyl)acrylate, METHYL2,5-DIHYDROXYCINNAMATE
Application Areas
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C10H10O4 |
| Molecular Weight | 194.0579 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 194.0579 Da |
| Heavy Atoms | 14 |
| Complexity | 224.0 |
| SMILES | COC(=O)C=CC1=C(C=CC(=C1)O)O |
| InChIKey | BQCNSTFWSKOWMA-UHFFFAOYSA-N |
Product Description
Applications: methyl (E)-3-(2,5-dihydroxyphenyl)acrylate is used in pharmaceutical synthesis routes and API production, as well as agrochemical development, including crop protection agent synthesis. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
methyl (E)-3-(2,5-dihydroxyphenyl)acrylate (CAS 63177-57-1) is a pharmaceutical intermediate with the molecular formula C10H10O4 and a molecular weight of 194.06 g/mol. Synonyms include erbstatin analog and Methyl 2,5-dihydroxycinnamate.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of methyl (E)-3-(2,5-dihydroxyphenyl)acrylate
Property Insights of methyl (E)-3-(2,5-dihydroxyphenyl)acrylate
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl (E)-3-(2,5-dihydroxyphenyl)acrylate. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl (E)-3-(2,5-dihydroxyphenyl)acrylate. Following Lipinski's Rule of Five, methyl (E)-3-(2,5-dihydroxyphenyl)acrylate has 2 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 methyl (E)-3-(2,5-dihydroxyphenyl)acrylate?
The CAS number of methyl (E)-3-(2,5-dihydroxyphenyl)acrylate is 63177-57-1.
What is the molecular formula of methyl (E)-3-(2,5-dihydroxyphenyl)acrylate?
The molecular formula of methyl (E)-3-(2,5-dihydroxyphenyl)acrylate is C10H10O4.
What is the molecular weight of methyl (E)-3-(2,5-dihydroxyphenyl)acrylate?
The molecular weight of methyl (E)-3-(2,5-dihydroxyphenyl)acrylate is 194.0579 g/mol.
What are the applications of methyl (E)-3-(2,5-dihydroxyphenyl)acrylate?
methyl (E)-3-(2,5-dihydroxyphenyl)acrylate is used in pharmaceutical synthesis routes and API production, as well as agrochemical development, including crop protection agent synthesis. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both...
Where can I buy methyl (E)-3-(2,5-dihydroxyphenyl)acrylate?
You can request a quote for methyl (E)-3-(2,5-dihydroxyphenyl)acrylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for methyl (E)-3-(2,5-dihydroxyphenyl)acrylate?
Yes, CoreyChem provides custom synthesis services for methyl (E)-3-(2,5-dihydroxyphenyl)acrylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.