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Ethyl 5-[(5-nitrofuran-2-yl)methylideneamino]furan-2-carboxylate
TL;DR: Ethyl 5-[(5-nitrofuran-2-yl)methylideneamino]furan-2-carboxylate (CAS 22929-69-7) is a chemical compound with molecular formula C12H10N2O6 and molecular weight 278.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-[(5-nitrofuran-2-yl)methylideneamino]furan-2-carboxylate
Also Known As: Ethyl 5-(((5-nitro-2-furanyl)methylene)amino)-2-furancarboxylate, ethyl 5-[(5-nitrofuran-2-yl)methylideneamino]furan-2-carboxylate, 2-Furancarboxylic acid, 5-(((5-nitro-2-furanyl)methylene)amino)-, ethyl ester, 2-Furancarboxylic acid, 5-[[(5-nitro-2-furanyl)methylene]amino]-, ethyl ester, 2-Furancarboxylic acid,5-[[(5-nitro-2-furanyl)methylene]amino]-, ethyl ester
| Molecular Formula | C12H10N2O6 |
|---|---|
| Molecular Weight | 278.05 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 111.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 278.0539 |
| Heavy Atoms | 20 |
| Complexity | 394.0 |
Chemical Identifiers
| CAS Number | 22929-69-7 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(O1)N=CC2=CC=C(O2)[N+](=O)[O-] |
| InChIKey | KQCOIYUNTWBYQW-UHFFFAOYSA-N |
Product Overview
Ethyl 5-[(5-nitrofuran-2-yl)methylideneamino]furan-2-carboxylate (CAS 22929-69-7), with molecular formula C12H10N2O6 and molecular weight 278.05 g/mol. IUPAC: ethyl 5-[(5-nitrofuran-2-yl)methylideneamino]furan-2-carboxylate.
Chemical Property Profile of Ethyl 5-[(5-nitrofuran-2-yl)methylideneamino]furan-2-carboxylate
Property Insights of Ethyl 5-[(5-nitrofuran-2-yl)methylideneamino]furan-2-carboxylate
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 5-[(5-nitrofuran-2-yl)methylideneamino]furan-2-carboxylate. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 5-[(5-nitrofuran-2-yl)methylideneamino]furan-2-carboxylate. Following Lipinski's Rule of Five, Ethyl 5-[(5-nitrofuran-2-yl)methylideneamino]furan-2-carboxylate has 0 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 Ethyl 5-[(5-nitrofuran-2-yl)methylideneamino]furan-2-carboxylate?
The CAS number of Ethyl 5-[(5-nitrofuran-2-yl)methylideneamino]furan-2-carboxylate is 22929-69-7.
What is the molecular formula of Ethyl 5-[(5-nitrofuran-2-yl)methylideneamino]furan-2-carboxylate?
The molecular formula of Ethyl 5-[(5-nitrofuran-2-yl)methylideneamino]furan-2-carboxylate is C12H10N2O6.
What is the molecular weight of Ethyl 5-[(5-nitrofuran-2-yl)methylideneamino]furan-2-carboxylate?
The molecular weight of Ethyl 5-[(5-nitrofuran-2-yl)methylideneamino]furan-2-carboxylate is 278.05 g/mol.
Where can I buy Ethyl 5-[(5-nitrofuran-2-yl)methylideneamino]furan-2-carboxylate?
You can request a quote for Ethyl 5-[(5-nitrofuran-2-yl)methylideneamino]furan-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 5-[(5-nitrofuran-2-yl)methylideneamino]furan-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 5-[(5-nitrofuran-2-yl)methylideneamino]furan-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.