2-cyano-N-(2,4-difluorophenyl)acetamide
TL;DR: 2-cyano-N-(2,4-difluorophenyl)acetamide (CAS 1961-38-2) is a chemical compound with molecular formula C9H6F2N2O and molecular weight 196.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-cyano-N-(2,4-difluorophenyl)acetamide
Also Known As: 2-cyano-N-(2,4-difluorophenyl)acetamide, 2-Cyano-N-(2,4-difluoro-phenyl)-acetamide, 2-Cyano-N-(2,4-difluorophenyl)-acetamide, IDI1_007693, N-(2,4-difluorophenyl)-2-cyanoacetamide
| Molecular Formula | C9H6F2N2O |
|---|---|
| Molecular Weight | 196.04 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 52.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 196.04482 |
| Heavy Atoms | 14 |
| Complexity | 261.0 |
Chemical Identifiers
| CAS Number | 1961-38-2 |
|---|---|
| SMILES | C1=CC(=C(C=C1F)F)NC(=O)CC#N |
| InChIKey | HRYUCAHUDHPLDZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-cyano-N-(2,4-difluorophenyl)acetamide (CAS 1961-38-2), with molecular formula C9H6F2N2O and molecular weight 196.04 g/mol. IUPAC: 2-cyano-N-(2,4-difluorophenyl)acetamide.
Chemical Property Profile of 2-cyano-N-(2,4-difluorophenyl)acetamide
Property Insights of 2-cyano-N-(2,4-difluorophenyl)acetamide
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-cyano-N-(2,4-difluorophenyl)acetamide. With a topological polar surface area (TPSA) of 52.9 Ų, 2-cyano-N-(2,4-difluorophenyl)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-cyano-N-(2,4-difluorophenyl)acetamide has 1 hydrogen bond donor(s) and 4 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 2-cyano-N-(2,4-difluorophenyl)acetamide?
The CAS number of 2-cyano-N-(2,4-difluorophenyl)acetamide is 1961-38-2.
What is the molecular formula of 2-cyano-N-(2,4-difluorophenyl)acetamide?
The molecular formula of 2-cyano-N-(2,4-difluorophenyl)acetamide is C9H6F2N2O.
What is the molecular weight of 2-cyano-N-(2,4-difluorophenyl)acetamide?
The molecular weight of 2-cyano-N-(2,4-difluorophenyl)acetamide is 196.04 g/mol.
Where can I buy 2-cyano-N-(2,4-difluorophenyl)acetamide?
You can request a quote for 2-cyano-N-(2,4-difluorophenyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-cyano-N-(2,4-difluorophenyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-cyano-N-(2,4-difluorophenyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.