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N-[(2-ethoxy-2-methylpropylidene)amino]-2,4-dinitroaniline
TL;DR: N-[(2-ethoxy-2-methylpropylidene)amino]-2,4-dinitroaniline (CAS 7472-06-2) is a chemical compound with molecular formula C12H16N4O5 and molecular weight 296.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2-ethoxy-2-methylpropylidene)amino]-2,4-dinitroaniline
Also Known As: N-[(2-ethoxy-2-methylpropylidene)amino]-2,4-dinitroaniline, N-[(2-ETHOXY-2-METHYL-PROPYLIDENE)AMINO]-2,4-DINITRO-ANILINE
| Molecular Formula | C12H16N4O5 |
|---|---|
| Molecular Weight | 296.11 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 125.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 296.11206 |
| Heavy Atoms | 21 |
| Complexity | 401.0 |
Chemical Identifiers
| CAS Number | 7472-06-2 |
|---|---|
| SMILES | CCOC(C)(C)C=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | MYPWWKZBBOSCTF-UHFFFAOYSA-N |
Product Overview
N-[(2-ethoxy-2-methylpropylidene)amino]-2,4-dinitroaniline (CAS 7472-06-2), with molecular formula C12H16N4O5 and molecular weight 296.11 g/mol. IUPAC: N-[(2-ethoxy-2-methylpropylidene)amino]-2,4-dinitroaniline.
Chemical Property Profile of N-[(2-ethoxy-2-methylpropylidene)amino]-2,4-dinitroaniline
Property Insights of N-[(2-ethoxy-2-methylpropylidene)amino]-2,4-dinitroaniline
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(2-ethoxy-2-methylpropylidene)amino]-2,4-dinitroaniline. The TPSA of 125.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(2-ethoxy-2-methylpropylidene)amino]-2,4-dinitroaniline. Following Lipinski's Rule of Five, N-[(2-ethoxy-2-methylpropylidene)amino]-2,4-dinitroaniline has 1 hydrogen bond donor(s) and 7 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-[(2-ethoxy-2-methylpropylidene)amino]-2,4-dinitroaniline?
The CAS number of N-[(2-ethoxy-2-methylpropylidene)amino]-2,4-dinitroaniline is 7472-06-2.
What is the molecular formula of N-[(2-ethoxy-2-methylpropylidene)amino]-2,4-dinitroaniline?
The molecular formula of N-[(2-ethoxy-2-methylpropylidene)amino]-2,4-dinitroaniline is C12H16N4O5.
What is the molecular weight of N-[(2-ethoxy-2-methylpropylidene)amino]-2,4-dinitroaniline?
The molecular weight of N-[(2-ethoxy-2-methylpropylidene)amino]-2,4-dinitroaniline is 296.11 g/mol.
Where can I buy N-[(2-ethoxy-2-methylpropylidene)amino]-2,4-dinitroaniline?
You can request a quote for N-[(2-ethoxy-2-methylpropylidene)amino]-2,4-dinitroaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(2-ethoxy-2-methylpropylidene)amino]-2,4-dinitroaniline?
Yes, KEHONG BIO provides custom synthesis services for N-[(2-ethoxy-2-methylpropylidene)amino]-2,4-dinitroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.