3-(5-Nitrofuran-2-yl)-1-(3-nitrophenyl)prop-2-en-1-one
TL;DR: 3-(5-Nitrofuran-2-yl)-1-(3-nitrophenyl)prop-2-en-1-one (CAS 63421-83-0) is a chemical compound with molecular formula C13H8N2O6 and molecular weight 288.03824 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(5-nitrofuran-2-yl)-1-(3-nitrophenyl)prop-2-en-1-one
Also Known As: 3-(5-Nitro-2-furyl)-3'-nitroacrylophenone, Acrylophenone, 3'-nitro-3-(5-nitro-2-furyl)-, ACRYLOPHENONE, 3-(5-NITRO-2-FURYL)-3'-NITRO-, 3-(5-nitrofuran-2-yl)-1-(3-nitrophenyl)prop-2-en-1-one, (E)-3-(5-nitrofuran-2-yl)-1-(3-nitrophenyl)prop-2-en-1-one
Technical Specifications
| Molecular Formula | C13H8N2O6 |
| Molecular Weight | 288.03824 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 122.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 288.03824 Da |
| Heavy Atoms | 21 |
| Complexity | 453.0 |
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)C=CC2=CC=C(O2)[N+](=O)[O-] |
| InChIKey | PTGULJNWIUVKES-UHFFFAOYSA-N |
Chemical Property Profile of 3-(5-Nitrofuran-2-yl)-1-(3-nitrophenyl)prop-2-en-1-one
Property Insights of 3-(5-Nitrofuran-2-yl)-1-(3-nitrophenyl)prop-2-en-1-one
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(5-Nitrofuran-2-yl)-1-(3-nitrophenyl)prop-2-en-1-one. The TPSA of 122.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(5-Nitrofuran-2-yl)-1-(3-nitrophenyl)prop-2-en-1-one. Following Lipinski's Rule of Five, 3-(5-Nitrofuran-2-yl)-1-(3-nitrophenyl)prop-2-en-1-one has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-(5-Nitrofuran-2-yl)-1-(3-nitrophenyl)prop-2-en-1-one?
The CAS number of 3-(5-Nitrofuran-2-yl)-1-(3-nitrophenyl)prop-2-en-1-one is 63421-83-0.
What is the molecular formula of 3-(5-Nitrofuran-2-yl)-1-(3-nitrophenyl)prop-2-en-1-one?
The molecular formula of 3-(5-Nitrofuran-2-yl)-1-(3-nitrophenyl)prop-2-en-1-one is C13H8N2O6.
What is the molecular weight of 3-(5-Nitrofuran-2-yl)-1-(3-nitrophenyl)prop-2-en-1-one?
The molecular weight of 3-(5-Nitrofuran-2-yl)-1-(3-nitrophenyl)prop-2-en-1-one is 288.03824 g/mol.
Where can I buy 3-(5-Nitrofuran-2-yl)-1-(3-nitrophenyl)prop-2-en-1-one?
You can request a quote for 3-(5-Nitrofuran-2-yl)-1-(3-nitrophenyl)prop-2-en-1-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(5-Nitrofuran-2-yl)-1-(3-nitrophenyl)prop-2-en-1-one?
Yes, CoreyChem provides custom synthesis services for 3-(5-Nitrofuran-2-yl)-1-(3-nitrophenyl)prop-2-en-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.