n-(3-Chloro-4-nitrophenyl)acetamide
TL;DR: n-(3-Chloro-4-nitrophenyl)acetamide (CAS 91393-60-1) is a chemical compound with molecular formula C8H7ClN2O3 and molecular weight 214.01453 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(3-chloro-4-nitrophenyl)acetamide
Also Known As: n-(3-chloro-4-nitrophenyl)acetamide, 3-Chloro-4-nitroacetanilide, Acetanilide, 3'-chloro-4'-nitro-, N-acetyl-3-chloro-4-nitroaniline, 2-chloro-4-acetylaminonitrobenzene
Application Areas
Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H7ClN2O3 |
| Molecular Weight | 214.01453 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 74.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 214.01453 Da |
| Heavy Atoms | 14 |
| Complexity | 241.0 |
| SMILES | CC(=O)NC1=CC(=C(C=C1)[N+](=O)[O-])Cl |
| InChIKey | KUAYZLXOOIEGDN-UHFFFAOYSA-N |
Chemical Property Profile of n-(3-Chloro-4-nitrophenyl)acetamide
Property Insights of n-(3-Chloro-4-nitrophenyl)acetamide
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for n-(3-Chloro-4-nitrophenyl)acetamide. The TPSA of 74.9 Ų falls within the moderate polarity range, balancing permeability and solubility for n-(3-Chloro-4-nitrophenyl)acetamide. Following Lipinski's Rule of Five, n-(3-Chloro-4-nitrophenyl)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
What is the CAS number of n-(3-Chloro-4-nitrophenyl)acetamide?
The CAS number of n-(3-Chloro-4-nitrophenyl)acetamide is 91393-60-1.
What is the molecular formula of n-(3-Chloro-4-nitrophenyl)acetamide?
The molecular formula of n-(3-Chloro-4-nitrophenyl)acetamide is C8H7ClN2O3.
What is the molecular weight of n-(3-Chloro-4-nitrophenyl)acetamide?
The molecular weight of n-(3-Chloro-4-nitrophenyl)acetamide is 214.01453 g/mol.
Where can I buy n-(3-Chloro-4-nitrophenyl)acetamide?
You can request a quote for n-(3-Chloro-4-nitrophenyl)acetamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for n-(3-Chloro-4-nitrophenyl)acetamide?
Yes, CoreyChem provides custom synthesis services for n-(3-Chloro-4-nitrophenyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.