N-(4-chloro-2-cyanophenyl)acetamide
TL;DR: N-(4-chloro-2-cyanophenyl)acetamide (CAS 53312-90-6) 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.
N-(4-chloro-2-cyanophenyl)acetamide
Also Known As: N-(4-chloro-2-cyanophenyl)acetamide, 2-cyano-4-chloroacetanilide, 2 -Cyano-4 -chloroacetoanilide, J3.604.383K, AE-562/12222958
| Molecular Formula | C9H7ClN2O |
|---|---|
| Molecular Weight | 194.02 g/mol |
| LogP | 2.17008 |
| Topological Polar Surface Area | 52.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 194.02469 |
| Heavy Atoms | 13 |
| Complexity | 381.69135 |
Chemical Identifiers
| CAS Number | 53312-90-6 |
|---|---|
| SMILES | CC(=O)NC1=C(C=C(C=C1)Cl)C#N |
Product Overview
N-(4-chloro-2-cyanophenyl)acetamide (CAS 53312-90-6), with molecular formula C9H7ClN2O and molecular weight 194.02 g/mol. IUPAC: N-(4-chloro-2-cyanophenyl)acetamide.
Chemical Property Profile of N-(4-chloro-2-cyanophenyl)acetamide
Property Insights of N-(4-chloro-2-cyanophenyl)acetamide
The XLogP value of 2.17008 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-chloro-2-cyanophenyl)acetamide. With a topological polar surface area (TPSA) of 52.89 Ų, N-(4-chloro-2-cyanophenyl)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-chloro-2-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 N-(4-chloro-2-cyanophenyl)acetamide?
The CAS number of N-(4-chloro-2-cyanophenyl)acetamide is 53312-90-6.
What is the molecular formula of N-(4-chloro-2-cyanophenyl)acetamide?
The molecular formula of N-(4-chloro-2-cyanophenyl)acetamide is C9H7ClN2O.
What is the molecular weight of N-(4-chloro-2-cyanophenyl)acetamide?
The molecular weight of N-(4-chloro-2-cyanophenyl)acetamide is 194.02 g/mol.
Where can I buy N-(4-chloro-2-cyanophenyl)acetamide?
You can request a quote for N-(4-chloro-2-cyanophenyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-chloro-2-cyanophenyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-chloro-2-cyanophenyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.