2'-Methoxy-4',5'-dinitroacetanilide
TL;DR: 2'-Methoxy-4',5'-dinitroacetanilide (CAS 66910-71-2) is a chemical compound with molecular formula C9H9N3O6 and molecular weight 255.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-methoxy-4,5-dinitrophenyl)acetamide
Also Known As: 2'-Methoxy-4',5'-dinitroacetanilide, N-(2-Methoxy-4,5-dinitrophenyl)acetamide, acetic acid-(2-methoxy-4,5-dinitro-anilide), N-(2-Methoxy-4,5-dinitrophenyl)acetamide #, Acetamide, N-(2-methoxy-4,5-dinitrophenyl)-
| Molecular Formula | C9H9N3O6 |
|---|---|
| Molecular Weight | 255.05 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 130.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 255.04913 |
| Heavy Atoms | 18 |
| Complexity | 349.0 |
Chemical Identifiers
| CAS Number | 66910-71-2 |
|---|---|
| SMILES | CC(=O)NC1=CC(=C(C=C1OC)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | TZZNDPCYNKMFKE-UHFFFAOYSA-N |
Product Overview
2'-Methoxy-4',5'-dinitroacetanilide (CAS 66910-71-2), with molecular formula C9H9N3O6 and molecular weight 255.05 g/mol. IUPAC: N-(2-methoxy-4,5-dinitrophenyl)acetamide.
Chemical Property Profile of 2'-Methoxy-4',5'-dinitroacetanilide
Property Insights of 2'-Methoxy-4',5'-dinitroacetanilide
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2'-Methoxy-4',5'-dinitroacetanilide. The TPSA of 130.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2'-Methoxy-4',5'-dinitroacetanilide. Following Lipinski's Rule of Five, 2'-Methoxy-4',5'-dinitroacetanilide has 1 hydrogen bond donor(s) and 6 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'-Methoxy-4',5'-dinitroacetanilide?
The CAS number of 2'-Methoxy-4',5'-dinitroacetanilide is 66910-71-2.
What is the molecular formula of 2'-Methoxy-4',5'-dinitroacetanilide?
The molecular formula of 2'-Methoxy-4',5'-dinitroacetanilide is C9H9N3O6.
What is the molecular weight of 2'-Methoxy-4',5'-dinitroacetanilide?
The molecular weight of 2'-Methoxy-4',5'-dinitroacetanilide is 255.05 g/mol.
Where can I buy 2'-Methoxy-4',5'-dinitroacetanilide?
You can request a quote for 2'-Methoxy-4',5'-dinitroacetanilide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2'-Methoxy-4',5'-dinitroacetanilide?
Yes, KEHONG BIO provides custom synthesis services for 2'-Methoxy-4',5'-dinitroacetanilide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.