2-Methyl-5-nitrobenzamide
TL;DR: 2-Methyl-5-nitrobenzamide (CAS 50825-99-5) is a chemical compound with molecular formula C8H8N2O3 and molecular weight 180.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-5-nitrobenzamide
Also Known As: 2-methyl-5-nitrobenzamide, Dinitolmide Impurity C, Dinitolmide Impurity 1, 2-Methyl-5-nitro-benzamide
| Molecular Formula | C8H8N2O3 |
|---|---|
| Molecular Weight | 180.05 g/mol |
| LogP | 1.00212 |
| Topological Polar Surface Area | 86.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 180.0535 |
| Heavy Atoms | 13 |
| Complexity | 373.65192 |
Chemical Identifiers
| CAS Number | 50825-99-5 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)N |
Product Overview
2-Methyl-5-nitrobenzamide (CAS 50825-99-5), with molecular formula C8H8N2O3 and molecular weight 180.05 g/mol. IUPAC: 2-methyl-5-nitrobenzamide.
Chemical Property Profile of 2-Methyl-5-nitrobenzamide
Property Insights of 2-Methyl-5-nitrobenzamide
The XLogP value of 1.00212 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-5-nitrobenzamide. The TPSA of 86.23 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methyl-5-nitrobenzamide. Following Lipinski's Rule of Five, 2-Methyl-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
Frequently Asked Questions
What is the CAS number of 2-Methyl-5-nitrobenzamide?
The CAS number of 2-Methyl-5-nitrobenzamide is 50825-99-5.
What is the molecular formula of 2-Methyl-5-nitrobenzamide?
The molecular formula of 2-Methyl-5-nitrobenzamide is C8H8N2O3.
What is the molecular weight of 2-Methyl-5-nitrobenzamide?
The molecular weight of 2-Methyl-5-nitrobenzamide is 180.05 g/mol.
Where can I buy 2-Methyl-5-nitrobenzamide?
You can request a quote for 2-Methyl-5-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-5-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-5-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.