Alpha-Cyano-4-Hydroxycinnamic Acid
TL;DR: Alpha-Cyano-4-Hydroxycinnamic Acid (CAS 28166-41-8) is a chemical compound with molecular formula C10H7NO3 and molecular weight 189.04259 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-cyano-3-(4-hydroxyphenyl)prop-2-enoic acid
Also Known As: alpha-cyano-4-hydroxycinnamic acid, alpha-CCA, alpha-Cyano, alpha-CHCA, alpha-Cyano-4-hydroxycinnamate
Application Areas
Top 5 of 17 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C10H7NO3 |
| Molecular Weight | 189.04259 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 81.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 189.04259 Da |
| Heavy Atoms | 14 |
| Complexity | 292.0 |
| SMILES | C1=CC(=CC=C1C=C(C#N)C(=O)O)O |
| InChIKey | AFVLVVWMAFSXCK-UHFFFAOYSA-N |
Product Description
Applications: Alpha-Cyano-4-Hydroxycinnamic Acid is used in pharmaceutical synthesis routes and API production, as well as analytical chemistry as a reagent, standard, or reference material. 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).
A pharmaceutical intermediate supplied by CoreyChem, Alpha-Cyano-4-Hydroxycinnamic Acid (CAS 28166-41-8) has the molecular formula C10H7NO3 and a molecular weight of 189.04 g/mol. Synonyms include alpha-cyano-4-hydroxycinnamic acid and alpha-CCA.
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 Alpha-Cyano-4-Hydroxycinnamic Acid
Property Insights of Alpha-Cyano-4-Hydroxycinnamic Acid
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Alpha-Cyano-4-Hydroxycinnamic Acid. The TPSA of 81.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Alpha-Cyano-4-Hydroxycinnamic Acid. Following Lipinski's Rule of Five, Alpha-Cyano-4-Hydroxycinnamic Acid 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 Alpha-Cyano-4-Hydroxycinnamic Acid?
The CAS number of Alpha-Cyano-4-Hydroxycinnamic Acid is 28166-41-8.
What is the molecular formula of Alpha-Cyano-4-Hydroxycinnamic Acid?
The molecular formula of Alpha-Cyano-4-Hydroxycinnamic Acid is C10H7NO3.
What is the molecular weight of Alpha-Cyano-4-Hydroxycinnamic Acid?
The molecular weight of Alpha-Cyano-4-Hydroxycinnamic Acid is 189.04259 g/mol.
What are the applications of Alpha-Cyano-4-Hydroxycinnamic Acid?
Alpha-Cyano-4-Hydroxycinnamic Acid is used in pharmaceutical synthesis routes and API production, as well as analytical chemistry as a reagent, standard, or reference material. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item...
Where can I buy Alpha-Cyano-4-Hydroxycinnamic Acid?
You can request a quote for Alpha-Cyano-4-Hydroxycinnamic Acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Alpha-Cyano-4-Hydroxycinnamic Acid?
Yes, CoreyChem provides custom synthesis services for Alpha-Cyano-4-Hydroxycinnamic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.