3-Methyl-2-nitrobenzamide
TL;DR: 3-Methyl-2-nitrobenzamide (CAS 60310-07-8) 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.
3-methyl-2-nitrobenzamide
Also Known As: 3-methyl-2-nitrobenzamide, Benzamide, 3-methyl-2-nitro-, 3-methyl-2-nitro-benzamide, J2.868.958F
| 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 | 60310-07-8 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C(=O)N)[N+](=O)[O-] |
Product Overview
3-Methyl-2-nitrobenzamide (CAS 60310-07-8), with molecular formula C8H8N2O3 and molecular weight 180.05 g/mol. IUPAC: 3-methyl-2-nitrobenzamide.
Chemical Property Profile of 3-Methyl-2-nitrobenzamide
Property Insights of 3-Methyl-2-nitrobenzamide
The XLogP value of 1.00212 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methyl-2-nitrobenzamide. The TPSA of 86.23 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Methyl-2-nitrobenzamide. Following Lipinski's Rule of Five, 3-Methyl-2-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 3-Methyl-2-nitrobenzamide?
The CAS number of 3-Methyl-2-nitrobenzamide is 60310-07-8.
What is the molecular formula of 3-Methyl-2-nitrobenzamide?
The molecular formula of 3-Methyl-2-nitrobenzamide is C8H8N2O3.
What is the molecular weight of 3-Methyl-2-nitrobenzamide?
The molecular weight of 3-Methyl-2-nitrobenzamide is 180.05 g/mol.
Where can I buy 3-Methyl-2-nitrobenzamide?
You can request a quote for 3-Methyl-2-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methyl-2-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-2-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.