3-(2-Chlorophenyl)-2-cyanoacrylamide
TL;DR: 3-(2-Chlorophenyl)-2-cyanoacrylamide (CAS 3533-10-6) is a chemical compound with molecular formula C10H7ClN2O and molecular weight 206.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-chlorophenyl)-2-cyanoprop-2-enamide
Also Known As: 3-(2-chlorophenyl)-2-cyanoprop-2-enamide, 3-(2-chlorophenyl)-2-cyanoacrylamide, 3-(2-Chlorophenyl)-2-cyano-prop-2-enamide
| Molecular Formula | C10H7ClN2O |
|---|---|
| Molecular Weight | 206.02 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 66.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 206.02469 |
| Heavy Atoms | 14 |
| Complexity | 302.0 |
Chemical Identifiers
| CAS Number | 3533-10-6 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C=C(C#N)C(=O)N)Cl |
| InChIKey | IZHILGRDFLIYQW-UHFFFAOYSA-N |
Product Overview
3-(2-Chlorophenyl)-2-cyanoacrylamide (CAS 3533-10-6), with molecular formula C10H7ClN2O and molecular weight 206.02 g/mol. IUPAC: 3-(2-chlorophenyl)-2-cyanoprop-2-enamide.
Chemical Property Profile of 3-(2-Chlorophenyl)-2-cyanoacrylamide
Property Insights of 3-(2-Chlorophenyl)-2-cyanoacrylamide
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2-Chlorophenyl)-2-cyanoacrylamide. The TPSA of 66.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2-Chlorophenyl)-2-cyanoacrylamide. Following Lipinski's Rule of Five, 3-(2-Chlorophenyl)-2-cyanoacrylamide 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 3-(2-Chlorophenyl)-2-cyanoacrylamide?
The CAS number of 3-(2-Chlorophenyl)-2-cyanoacrylamide is 3533-10-6.
What is the molecular formula of 3-(2-Chlorophenyl)-2-cyanoacrylamide?
The molecular formula of 3-(2-Chlorophenyl)-2-cyanoacrylamide is C10H7ClN2O.
What is the molecular weight of 3-(2-Chlorophenyl)-2-cyanoacrylamide?
The molecular weight of 3-(2-Chlorophenyl)-2-cyanoacrylamide is 206.02 g/mol.
Where can I buy 3-(2-Chlorophenyl)-2-cyanoacrylamide?
You can request a quote for 3-(2-Chlorophenyl)-2-cyanoacrylamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-Chlorophenyl)-2-cyanoacrylamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-Chlorophenyl)-2-cyanoacrylamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.