2-[1-Amino-2-(4-nitrophenoxy)ethylidene]propanedinitrile
TL;DR: 2-[1-Amino-2-(4-nitrophenoxy)ethylidene]propanedinitrile (CAS 343375-41-7) is a chemical compound with molecular formula C11H8N4O3 and molecular weight 244.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-amino-2-(4-nitrophenoxy)ethylidene]propanedinitrile
Also Known As: 2-[1-amino-2-(4-nitrophenoxy)ethylidene]propanedinitrile, aminonitrophenoxyethylidenemalononitrile, 2-(1-Amino-2-(4-nitrophenoxy)ethylidene)malononitrile, 2-[1-Amino-2-(4-nitrophenoxy)ethylidene]-malononitrile, 2-[1-amino-2-(4-nitrophenoxy)ethylidene]malononitrile
| Molecular Formula | C11H8N4O3 |
|---|---|
| Molecular Weight | 244.06 g/mol |
| LogP | 1.23356 |
| Topological Polar Surface Area | 125.97 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 244.05965 |
| Heavy Atoms | 18 |
| Complexity | 547.4365 |
Chemical Identifiers
| CAS Number | 343375-41-7 |
|---|---|
| SMILES | C1=CC(=CC=C1[N+](=O)[O-])OCC(=C(C#N)C#N)N |
Product Overview
2-[1-Amino-2-(4-nitrophenoxy)ethylidene]propanedinitrile (CAS 343375-41-7), with molecular formula C11H8N4O3 and molecular weight 244.06 g/mol. IUPAC: 2-[1-amino-2-(4-nitrophenoxy)ethylidene]propanedinitrile.
Chemical Property Profile of 2-[1-Amino-2-(4-nitrophenoxy)ethylidene]propanedinitrile
Property Insights of 2-[1-Amino-2-(4-nitrophenoxy)ethylidene]propanedinitrile
The XLogP value of 1.23356 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[1-Amino-2-(4-nitrophenoxy)ethylidene]propanedinitrile. The TPSA of 125.97 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[1-Amino-2-(4-nitrophenoxy)ethylidene]propanedinitrile. Following Lipinski's Rule of Five, 2-[1-Amino-2-(4-nitrophenoxy)ethylidene]propanedinitrile 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-[1-Amino-2-(4-nitrophenoxy)ethylidene]propanedinitrile?
The CAS number of 2-[1-Amino-2-(4-nitrophenoxy)ethylidene]propanedinitrile is 343375-41-7.
What is the molecular formula of 2-[1-Amino-2-(4-nitrophenoxy)ethylidene]propanedinitrile?
The molecular formula of 2-[1-Amino-2-(4-nitrophenoxy)ethylidene]propanedinitrile is C11H8N4O3.
What is the molecular weight of 2-[1-Amino-2-(4-nitrophenoxy)ethylidene]propanedinitrile?
The molecular weight of 2-[1-Amino-2-(4-nitrophenoxy)ethylidene]propanedinitrile is 244.06 g/mol.
Where can I buy 2-[1-Amino-2-(4-nitrophenoxy)ethylidene]propanedinitrile?
You can request a quote for 2-[1-Amino-2-(4-nitrophenoxy)ethylidene]propanedinitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[1-Amino-2-(4-nitrophenoxy)ethylidene]propanedinitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[1-Amino-2-(4-nitrophenoxy)ethylidene]propanedinitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.