![2-[(4-Nitrophenyl)methylidene]indene-1,3-dione structure](/static/products/1595/15951-41-4.webp)
2-[(4-Nitrophenyl)methylidene]indene-1,3-dione
TL;DR: 2-[(4-Nitrophenyl)methylidene]indene-1,3-dione (CAS 15951-41-4) is a chemical compound with molecular formula C16H9NO4 and molecular weight 279.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-nitrophenyl)methylidene]indene-1,3-dione
Also Known As: 2-(4-Nitro-benzylidene)-indan-1,3-dione, 2-(4-Nitrobenzylidene)-1,3-indandione, 2-p-nitrobenzylideneindan-1,3-dione, 2-(p-Nitrobenzylidene)indan-1,3-dione, 2-(4-Nitrobenzylidene)indan-1,3-dione
| Molecular Formula | C16H9NO4 |
|---|---|
| Molecular Weight | 279.05 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 80.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 279.05316 |
| Heavy Atoms | 21 |
| Complexity | 471.0 |
Chemical Identifiers
| CAS Number | 15951-41-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C(=CC3=CC=C(C=C3)[N+](=O)[O-])C2=O |
| InChIKey | DFDZATIUTSXUPX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-[(4-Nitrophenyl)methylidene]indene-1,3-dione (CAS 15951-41-4), with molecular formula C16H9NO4 and molecular weight 279.05 g/mol. IUPAC: 2-[(4-nitrophenyl)methylidene]indene-1,3-dione.
Chemical Property Profile of 2-[(4-Nitrophenyl)methylidene]indene-1,3-dione
Property Insights of 2-[(4-Nitrophenyl)methylidene]indene-1,3-dione
The XLogP value of 3.3 indicates that 2-[(4-Nitrophenyl)methylidene]indene-1,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(4-Nitrophenyl)methylidene]indene-1,3-dione. Following Lipinski's Rule of Five, 2-[(4-Nitrophenyl)methylidene]indene-1,3-dione has 0 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-[(4-Nitrophenyl)methylidene]indene-1,3-dione?
The CAS number of 2-[(4-Nitrophenyl)methylidene]indene-1,3-dione is 15951-41-4.
What is the molecular formula of 2-[(4-Nitrophenyl)methylidene]indene-1,3-dione?
The molecular formula of 2-[(4-Nitrophenyl)methylidene]indene-1,3-dione is C16H9NO4.
What is the molecular weight of 2-[(4-Nitrophenyl)methylidene]indene-1,3-dione?
The molecular weight of 2-[(4-Nitrophenyl)methylidene]indene-1,3-dione is 279.05 g/mol.
Where can I buy 2-[(4-Nitrophenyl)methylidene]indene-1,3-dione?
You can request a quote for 2-[(4-Nitrophenyl)methylidene]indene-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(4-Nitrophenyl)methylidene]indene-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-Nitrophenyl)methylidene]indene-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.