N-ethyl-2-chloro-5-nitrobenzamide
TL;DR: N-ethyl-2-chloro-5-nitrobenzamide (CAS 117054-83-8) is a chemical compound with molecular formula C9H9ClN2O3 and molecular weight 228.03017 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-chloro-N-ethyl-5-nitrobenzamide
Also Known As: N-ethyl-2-chloro-5-nitrobenzamide, 2-chloro-N-ethyl-5-nitrobenzamide, N-ethyl-2chloro-5-nitrobenzamide, 2-chloro-N-ethyl-5-nitro-benzamide
Technical Specifications
| Molecular Formula | C9H9ClN2O3 |
| Molecular Weight | 228.03017 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 74.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 228.03017 Da |
| Heavy Atoms | 15 |
| Complexity | 254.0 |
| SMILES | CCNC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])Cl |
| InChIKey | UXBYXADXVPGIPA-UHFFFAOYSA-N |
Chemical Property Profile of N-ethyl-2-chloro-5-nitrobenzamide
Property Insights of N-ethyl-2-chloro-5-nitrobenzamide
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-ethyl-2-chloro-5-nitrobenzamide. The TPSA of 74.9 Ų falls within the moderate polarity range, balancing permeability and solubility for N-ethyl-2-chloro-5-nitrobenzamide. Following Lipinski's Rule of Five, N-ethyl-2-chloro-5-nitrobenzamide 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-ethyl-2-chloro-5-nitrobenzamide?
The CAS number of N-ethyl-2-chloro-5-nitrobenzamide is 117054-83-8.
What is the molecular formula of N-ethyl-2-chloro-5-nitrobenzamide?
The molecular formula of N-ethyl-2-chloro-5-nitrobenzamide is C9H9ClN2O3.
What is the molecular weight of N-ethyl-2-chloro-5-nitrobenzamide?
The molecular weight of N-ethyl-2-chloro-5-nitrobenzamide is 228.03017 g/mol.
Where can I buy N-ethyl-2-chloro-5-nitrobenzamide?
You can request a quote for N-ethyl-2-chloro-5-nitrobenzamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-ethyl-2-chloro-5-nitrobenzamide?
Yes, CoreyChem provides custom synthesis services for N-ethyl-2-chloro-5-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.