2-chloro-N-(3-cyanophenyl)acetamide
TL;DR: 2-chloro-N-(3-cyanophenyl)acetamide (CAS 218288-43-8) is a chemical compound with molecular formula C9H7ClN2O and molecular weight 194.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-(3-cyanophenyl)acetamide
Also Known As: 2-chloro-N-(3-cyanophenyl)acetamide, N1-(3-cyanophenyl)-2-chloroacetamide, 4,4-dihexylazoxybenzene, 2-Chloro-N-(3-cyanophenyl)-acetamide, N1- -2-CHLOROACETAMIDE
| Molecular Formula | C9H7ClN2O |
|---|---|
| Molecular Weight | 194.02 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 52.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 194.02469 |
| Heavy Atoms | 13 |
| Complexity | 233.0 |
Chemical Identifiers
| CAS Number | 218288-43-8 |
|---|---|
| SMILES | C1=CC(=CC(=C1)NC(=O)CCl)C#N |
| InChIKey | SSCHGFNXYGVLSG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-chloro-N-(3-cyanophenyl)acetamide (CAS 218288-43-8), with molecular formula C9H7ClN2O and molecular weight 194.02 g/mol. IUPAC: 2-chloro-N-(3-cyanophenyl)acetamide.
Chemical Property Profile of 2-chloro-N-(3-cyanophenyl)acetamide
Property Insights of 2-chloro-N-(3-cyanophenyl)acetamide
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-chloro-N-(3-cyanophenyl)acetamide. With a topological polar surface area (TPSA) of 52.9 Ų, 2-chloro-N-(3-cyanophenyl)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-chloro-N-(3-cyanophenyl)acetamide 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 2-chloro-N-(3-cyanophenyl)acetamide?
The CAS number of 2-chloro-N-(3-cyanophenyl)acetamide is 218288-43-8.
What is the molecular formula of 2-chloro-N-(3-cyanophenyl)acetamide?
The molecular formula of 2-chloro-N-(3-cyanophenyl)acetamide is C9H7ClN2O.
What is the molecular weight of 2-chloro-N-(3-cyanophenyl)acetamide?
The molecular weight of 2-chloro-N-(3-cyanophenyl)acetamide is 194.02 g/mol.
Where can I buy 2-chloro-N-(3-cyanophenyl)acetamide?
You can request a quote for 2-chloro-N-(3-cyanophenyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-N-(3-cyanophenyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-N-(3-cyanophenyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.