(E)-2-((5-nitrofuran-2-yl)methylene)-1,3-dioxo-2,3-dihydro-1H-indene-5-carboxylic acid
TL;DR: (E)-2-((5-nitrofuran-2-yl)methylene)-1,3-dioxo-2,3-dihydro-1H-indene-5-carboxylic acid (CAS 451461-46-4) is a chemical compound with molecular formula C15H7NO7 and molecular weight 313.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E)-2-[(5-nitrofuran-2-yl)methylidene]-1,3-dioxoindene-5-carboxylic acid
Also Known As: (E)-2-((5-nitrofuran-2-yl)methylene)-1,3-dioxo-2,3-dihydro-1H-indene-5-carboxylic acid, (2E)-2-[(5-nitrofuran-2-yl)methylidene]-1,3-dioxoindene-5-carboxylic acid, 2-[(5-nitro-2-furyl)methylidene]-1,3-dioxo-indene-5-carboxylic Acid, 2-((5-Nitrofuran-2-yl)methylene)-1,3-dioxo-2,3-dihydro-1H-indene-5-carboxylic acid
| Molecular Formula | C15H7NO7 |
|---|---|
| Molecular Weight | 313.02 g/mol |
| LogP | 2.3486 |
| Topological Polar Surface Area | 127.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 313.02225 |
| Heavy Atoms | 23 |
| Complexity | 919.6567 |
Chemical Identifiers
| CAS Number | 451461-46-4 |
|---|---|
| SMILES | C1=CC2=C(C=C1C(=O)O)C(=O)/C(=C/C3=CC=C(O3)[N+](=O)[O-])/C2=O |
Product Overview
(E)-2-((5-nitrofuran-2-yl)methylene)-1,3-dioxo-2,3-dihydro-1H-indene-5-carboxylic acid (CAS 451461-46-4), with molecular formula C15H7NO7 and molecular weight 313.02 g/mol. IUPAC: (2E)-2-[(5-nitrofuran-2-yl)methylidene]-1,3-dioxoindene-5-carboxylic acid.
Chemical Property Profile of (E)-2-((5-nitrofuran-2-yl)methylene)-1,3-dioxo-2,3-dihydro-1H-indene-5-carboxylic acid
Property Insights of (E)-2-((5-nitrofuran-2-yl)methylene)-1,3-dioxo-2,3-dihydro-1H-indene-5-carboxylic acid
The XLogP value of 2.3486 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-2-((5-nitrofuran-2-yl)methylene)-1,3-dioxo-2,3-dihydro-1H-indene-5-carboxylic acid. The TPSA of 127.72 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-2-((5-nitrofuran-2-yl)methylene)-1,3-dioxo-2,3-dihydro-1H-indene-5-carboxylic acid. Following Lipinski's Rule of Five, (E)-2-((5-nitrofuran-2-yl)methylene)-1,3-dioxo-2,3-dihydro-1H-indene-5-carboxylic acid 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 (E)-2-((5-nitrofuran-2-yl)methylene)-1,3-dioxo-2,3-dihydro-1H-indene-5-carboxylic acid?
The CAS number of (E)-2-((5-nitrofuran-2-yl)methylene)-1,3-dioxo-2,3-dihydro-1H-indene-5-carboxylic acid is 451461-46-4.
What is the molecular formula of (E)-2-((5-nitrofuran-2-yl)methylene)-1,3-dioxo-2,3-dihydro-1H-indene-5-carboxylic acid?
The molecular formula of (E)-2-((5-nitrofuran-2-yl)methylene)-1,3-dioxo-2,3-dihydro-1H-indene-5-carboxylic acid is C15H7NO7.
What is the molecular weight of (E)-2-((5-nitrofuran-2-yl)methylene)-1,3-dioxo-2,3-dihydro-1H-indene-5-carboxylic acid?
The molecular weight of (E)-2-((5-nitrofuran-2-yl)methylene)-1,3-dioxo-2,3-dihydro-1H-indene-5-carboxylic acid is 313.02 g/mol.
Where can I buy (E)-2-((5-nitrofuran-2-yl)methylene)-1,3-dioxo-2,3-dihydro-1H-indene-5-carboxylic acid?
You can request a quote for (E)-2-((5-nitrofuran-2-yl)methylene)-1,3-dioxo-2,3-dihydro-1H-indene-5-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-2-((5-nitrofuran-2-yl)methylene)-1,3-dioxo-2,3-dihydro-1H-indene-5-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-((5-nitrofuran-2-yl)methylene)-1,3-dioxo-2,3-dihydro-1H-indene-5-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.