alpha-Cyano-3-fluorocinnamamide
TL;DR: alpha-Cyano-3-fluorocinnamamide (CAS 100908-62-1) is a chemical compound with molecular formula C10H7FN2O and molecular weight 190.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-cyano-3-(3-fluorophenyl)prop-2-enamide
Also Known As: alpha-Cyano-3-fluorocinnamamide, 2-cyano-3-(3-fluorophenyl)prop-2-enamide, 2-Cyano-3-(m-fluorophenyl)acrylamide, 2-Propenamide,2-cyano-3-(3-fluorophenyl)-, 2-(3-Fluorobenzylidene)-2-cyanoacetamide
| Molecular Formula | C10H7FN2O |
|---|---|
| Molecular Weight | 190.05 g/mol |
| LogP | 1.21798 |
| Topological Polar Surface Area | 66.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 190.05424 |
| Heavy Atoms | 14 |
| Complexity | 431.9933 |
Chemical Identifiers
| CAS Number | 100908-62-1 |
|---|---|
| SMILES | C1=CC(=CC(=C1)F)C=C(C#N)C(=O)N |
Product Overview
alpha-Cyano-3-fluorocinnamamide (CAS 100908-62-1), with molecular formula C10H7FN2O and molecular weight 190.05 g/mol. IUPAC: 2-cyano-3-(3-fluorophenyl)prop-2-enamide.
Chemical Property Profile of alpha-Cyano-3-fluorocinnamamide
Property Insights of alpha-Cyano-3-fluorocinnamamide
The XLogP value of 1.21798 suggests moderate lipophilicity, balancing water solubility and membrane permeability for alpha-Cyano-3-fluorocinnamamide. The TPSA of 66.88 Ų falls within the moderate polarity range, balancing permeability and solubility for alpha-Cyano-3-fluorocinnamamide. Following Lipinski's Rule of Five, alpha-Cyano-3-fluorocinnamamide has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of alpha-Cyano-3-fluorocinnamamide?
The CAS number of alpha-Cyano-3-fluorocinnamamide is 100908-62-1.
What is the molecular formula of alpha-Cyano-3-fluorocinnamamide?
The molecular formula of alpha-Cyano-3-fluorocinnamamide is C10H7FN2O.
What is the molecular weight of alpha-Cyano-3-fluorocinnamamide?
The molecular weight of alpha-Cyano-3-fluorocinnamamide is 190.05 g/mol.
Where can I buy alpha-Cyano-3-fluorocinnamamide?
You can request a quote for alpha-Cyano-3-fluorocinnamamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-Cyano-3-fluorocinnamamide?
Yes, KEHONG BIO provides custom synthesis services for alpha-Cyano-3-fluorocinnamamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.