2,2-Dimethyl-4'-methoxy-2'-nitropropionanilide
TL;DR: 2,2-Dimethyl-4'-methoxy-2'-nitropropionanilide (CAS 85429-91-0) is a chemical compound with molecular formula C12H16N2O4 and molecular weight 252.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-methoxy-2-nitrophenyl)-2,2-dimethylpropanamide
Also Known As: N-(4-Methoxy-2-nitrophenyl)pivalamide, 2,2-DIMETHYL-4'-METHOXY-2'-NITROPROPIONANILIDE, N-(4-methoxy-2-nitrophenyl)-2,2-dimethylpropanamide, N-(4-methoxy-2-nitro-phenyl)-2,2-dimethyl-propanamide
| Molecular Formula | C12H16N2O4 |
|---|---|
| Molecular Weight | 252.11 g/mol |
| LogP | 2.588 |
| Topological Polar Surface Area | 81.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 252.11101 |
| Heavy Atoms | 18 |
| Complexity | 477.45602 |
Chemical Identifiers
| CAS Number | 85429-91-0 |
|---|---|
| SMILES | CC(C)(C)C(=O)NC1=C(C=C(C=C1)OC)[N+](=O)[O-] |
Product Overview
2,2-Dimethyl-4'-methoxy-2'-nitropropionanilide (CAS 85429-91-0), with molecular formula C12H16N2O4 and molecular weight 252.11 g/mol. IUPAC: N-(4-methoxy-2-nitrophenyl)-2,2-dimethylpropanamide.
Chemical Property Profile of 2,2-Dimethyl-4'-methoxy-2'-nitropropionanilide
Property Insights of 2,2-Dimethyl-4'-methoxy-2'-nitropropionanilide
The XLogP value of 2.588 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2-Dimethyl-4'-methoxy-2'-nitropropionanilide. The TPSA of 81.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2-Dimethyl-4'-methoxy-2'-nitropropionanilide. Following Lipinski's Rule of Five, 2,2-Dimethyl-4'-methoxy-2'-nitropropionanilide has 1 hydrogen bond donor(s) and 4 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 2,2-Dimethyl-4'-methoxy-2'-nitropropionanilide?
The CAS number of 2,2-Dimethyl-4'-methoxy-2'-nitropropionanilide is 85429-91-0.
What is the molecular formula of 2,2-Dimethyl-4'-methoxy-2'-nitropropionanilide?
The molecular formula of 2,2-Dimethyl-4'-methoxy-2'-nitropropionanilide is C12H16N2O4.
What is the molecular weight of 2,2-Dimethyl-4'-methoxy-2'-nitropropionanilide?
The molecular weight of 2,2-Dimethyl-4'-methoxy-2'-nitropropionanilide is 252.11 g/mol.
Where can I buy 2,2-Dimethyl-4'-methoxy-2'-nitropropionanilide?
You can request a quote for 2,2-Dimethyl-4'-methoxy-2'-nitropropionanilide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-Dimethyl-4'-methoxy-2'-nitropropionanilide?
Yes, KEHONG BIO provides custom synthesis services for 2,2-Dimethyl-4'-methoxy-2'-nitropropionanilide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.