2-cyano-3-(3,4-dichlorophenyl)prop-2-enoic Acid
TL;DR: 2-cyano-3-(3,4-dichlorophenyl)prop-2-enoic Acid (CAS 103037-72-5) is a chemical compound with molecular formula C10H5Cl2NO2 and molecular weight 240.96973 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-cyano-3-(3,4-dichlorophenyl)prop-2-enoic acid
Also Known As: 2-cyano-3-(3,4-dichlorophenyl)prop-2-enoic Acid, (2Z)-2-cyano-3-(3,4-dichlorophenyl)acrylic acid, CID 3795364
Technical Specifications
| Molecular Formula | C10H5Cl2NO2 |
| Molecular Weight | 240.96973 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 61.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 240.96973 Da |
| Heavy Atoms | 15 |
| Complexity | 332.0 |
| SMILES | C1=CC(=C(C=C1C=C(C#N)C(=O)O)Cl)Cl |
| InChIKey | YIHQQDWZQKQXQE-UHFFFAOYSA-N |
Chemical Property Profile of 2-cyano-3-(3,4-dichlorophenyl)prop-2-enoic Acid
Property Insights of 2-cyano-3-(3,4-dichlorophenyl)prop-2-enoic Acid
The XLogP value of 3.1 indicates that 2-cyano-3-(3,4-dichlorophenyl)prop-2-enoic Acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-cyano-3-(3,4-dichlorophenyl)prop-2-enoic Acid. Following Lipinski's Rule of Five, 2-cyano-3-(3,4-dichlorophenyl)prop-2-enoic 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 2-cyano-3-(3,4-dichlorophenyl)prop-2-enoic Acid?
The CAS number of 2-cyano-3-(3,4-dichlorophenyl)prop-2-enoic Acid is 103037-72-5.
What is the molecular formula of 2-cyano-3-(3,4-dichlorophenyl)prop-2-enoic Acid?
The molecular formula of 2-cyano-3-(3,4-dichlorophenyl)prop-2-enoic Acid is C10H5Cl2NO2.
What is the molecular weight of 2-cyano-3-(3,4-dichlorophenyl)prop-2-enoic Acid?
The molecular weight of 2-cyano-3-(3,4-dichlorophenyl)prop-2-enoic Acid is 240.96973 g/mol.
Where can I buy 2-cyano-3-(3,4-dichlorophenyl)prop-2-enoic Acid?
You can request a quote for 2-cyano-3-(3,4-dichlorophenyl)prop-2-enoic Acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-cyano-3-(3,4-dichlorophenyl)prop-2-enoic Acid?
Yes, CoreyChem provides custom synthesis services for 2-cyano-3-(3,4-dichlorophenyl)prop-2-enoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.