2-cyano-N-(2-fluorophenyl)acetamide
TL;DR: 2-cyano-N-(2-fluorophenyl)acetamide (CAS 1735-96-2) is a chemical compound with molecular formula C9H7FN2O and molecular weight 178.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-cyano-N-(2-fluorophenyl)acetamide
Also Known As: 2-cyano-N-(2-fluorophenyl)acetamide, Acetamide, 2-cyano-N-(2-fluorophenyl)-, Maybridge1_001484, 2-Cyano-N-(2-fluoro-phenyl)-acetamide, 2-Cyano-N-(2-fluorophenyl)-acetamide
| Molecular Formula | C9H7FN2O |
|---|---|
| Molecular Weight | 178.05 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 52.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 178.05424 |
| Heavy Atoms | 13 |
| Complexity | 233.0 |
Chemical Identifiers
| CAS Number | 1735-96-2 |
|---|---|
| SMILES | C1=CC=C(C(=C1)NC(=O)CC#N)F |
| InChIKey | RDAXFILTEIFLSA-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-fluorophenyl)acetamide (CAS 1735-96-2), with molecular formula C9H7FN2O and molecular weight 178.05 g/mol. IUPAC: 2-cyano-N-(2-fluorophenyl)acetamide.
Chemical Property Profile of 2-cyano-N-(2-fluorophenyl)acetamide
Property Insights of 2-cyano-N-(2-fluorophenyl)acetamide
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-cyano-N-(2-fluorophenyl)acetamide. With a topological polar surface area (TPSA) of 52.9 Ų, 2-cyano-N-(2-fluorophenyl)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-cyano-N-(2-fluorophenyl)acetamide 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
Frequently Asked Questions
What is the CAS number of 2-cyano-N-(2-fluorophenyl)acetamide?
The CAS number of 2-cyano-N-(2-fluorophenyl)acetamide is 1735-96-2.
What is the molecular formula of 2-cyano-N-(2-fluorophenyl)acetamide?
The molecular formula of 2-cyano-N-(2-fluorophenyl)acetamide is C9H7FN2O.
What is the molecular weight of 2-cyano-N-(2-fluorophenyl)acetamide?
The molecular weight of 2-cyano-N-(2-fluorophenyl)acetamide is 178.05 g/mol.
Where can I buy 2-cyano-N-(2-fluorophenyl)acetamide?
You can request a quote for 2-cyano-N-(2-fluorophenyl)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-fluorophenyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-cyano-N-(2-fluorophenyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.