2-Chloro-4-nitrobenzanilide
TL;DR: 2-Chloro-4-nitrobenzanilide (CAS 71501-31-0) is a chemical compound with molecular formula C13H9ClN2O3 and molecular weight 276.03018 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-chloro-4-nitro-N-phenylbenzamide
Also Known As: 2-Chloro-4-nitrobenzanilide, 2-chloro-4-nitro-n-phenylbenzamide, 2-CHLORO-4-NITRO BENZANILIDE, Benzamide,2-chloro-4-nitro-N-phenyl-, 2-chloro-4-nitro-N-phenyl-benzamide
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C13H9ClN2O3 |
| Molecular Weight | 276.03018 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 74.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 276.03018 Da |
| Heavy Atoms | 19 |
| Complexity | 339.0 |
| SMILES | C1=CC=C(C=C1)NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl |
| InChIKey | HKFKBQGYOFOVFH-UHFFFAOYSA-N |
Chemical Property Profile of 2-Chloro-4-nitrobenzanilide
Property Insights of 2-Chloro-4-nitrobenzanilide
The XLogP value of 3.3 indicates that 2-Chloro-4-nitrobenzanilide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Chloro-4-nitrobenzanilide. Following Lipinski's Rule of Five, 2-Chloro-4-nitrobenzanilide 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 2-Chloro-4-nitrobenzanilide?
The CAS number of 2-Chloro-4-nitrobenzanilide is 71501-31-0.
What is the molecular formula of 2-Chloro-4-nitrobenzanilide?
The molecular formula of 2-Chloro-4-nitrobenzanilide is C13H9ClN2O3.
What is the molecular weight of 2-Chloro-4-nitrobenzanilide?
The molecular weight of 2-Chloro-4-nitrobenzanilide is 276.03018 g/mol.
Where can I buy 2-Chloro-4-nitrobenzanilide?
You can request a quote for 2-Chloro-4-nitrobenzanilide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Chloro-4-nitrobenzanilide?
Yes, CoreyChem provides custom synthesis services for 2-Chloro-4-nitrobenzanilide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.