N-(3-chloro-4-methyl-2,6-dinitrophenyl)acetamide
TL;DR: N-(3-chloro-4-methyl-2,6-dinitrophenyl)acetamide (CAS 439096-91-0) is a chemical compound with molecular formula C9H8ClN3O5 and molecular weight 273.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chloro-4-methyl-2,6-dinitrophenyl)acetamide
Also Known As: N-(3-chloro-4-methyl-2,6-dinitrophenyl)acetamide, 10R-0626
| Molecular Formula | C9H8ClN3O5 |
|---|---|
| Molecular Weight | 273.02 g/mol |
| LogP | 2.42322 |
| Topological Polar Surface Area | 115.38 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 273.01526 |
| Heavy Atoms | 18 |
| Complexity | 557.6243 |
Chemical Identifiers
| CAS Number | 439096-91-0 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1Cl)[N+](=O)[O-])NC(=O)C)[N+](=O)[O-] |
Product Overview
N-(3-chloro-4-methyl-2,6-dinitrophenyl)acetamide (CAS 439096-91-0), with molecular formula C9H8ClN3O5 and molecular weight 273.02 g/mol. IUPAC: N-(3-chloro-4-methyl-2,6-dinitrophenyl)acetamide.
Chemical Property Profile of N-(3-chloro-4-methyl-2,6-dinitrophenyl)acetamide
Property Insights of N-(3-chloro-4-methyl-2,6-dinitrophenyl)acetamide
The XLogP value of 2.42322 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-chloro-4-methyl-2,6-dinitrophenyl)acetamide. The TPSA of 115.38 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-chloro-4-methyl-2,6-dinitrophenyl)acetamide. Following Lipinski's Rule of Five, N-(3-chloro-4-methyl-2,6-dinitrophenyl)acetamide has 1 hydrogen bond donor(s) and 5 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-(3-chloro-4-methyl-2,6-dinitrophenyl)acetamide?
The CAS number of N-(3-chloro-4-methyl-2,6-dinitrophenyl)acetamide is 439096-91-0.
What is the molecular formula of N-(3-chloro-4-methyl-2,6-dinitrophenyl)acetamide?
The molecular formula of N-(3-chloro-4-methyl-2,6-dinitrophenyl)acetamide is C9H8ClN3O5.
What is the molecular weight of N-(3-chloro-4-methyl-2,6-dinitrophenyl)acetamide?
The molecular weight of N-(3-chloro-4-methyl-2,6-dinitrophenyl)acetamide is 273.02 g/mol.
Where can I buy N-(3-chloro-4-methyl-2,6-dinitrophenyl)acetamide?
You can request a quote for N-(3-chloro-4-methyl-2,6-dinitrophenyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-chloro-4-methyl-2,6-dinitrophenyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-chloro-4-methyl-2,6-dinitrophenyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.