2-Propen-1-one, 3-(2-chlorophenyl)-1-(5-nitro-2-furanyl)-
TL;DR: 2-Propen-1-one, 3-(2-chlorophenyl)-1-(5-nitro-2-furanyl)- (CAS 77604-96-7) is a chemical compound with molecular formula C13H8ClNO4 and molecular weight 277.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-chlorophenyl)-1-(5-nitrofuran-2-yl)prop-2-en-1-one
Also Known As: 3-(2-chlorophenyl)-1-(5-nitrofuran-2-yl)prop-2-en-1-one, 2-Propen-1-one, 3-(2-chlorophenyl)-1-(5-nitro-2-furanyl)-, 3-(2-chlorophenyl)-1-(5-nitro-2-furyl)prop-2-en-1-one
| Molecular Formula | C13H8ClNO4 |
|---|---|
| Molecular Weight | 277.01 g/mol |
| LogP | 3.7373 |
| Topological Polar Surface Area | 73.35 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 277.0142 |
| Heavy Atoms | 19 |
| Complexity | 660.1678 |
Chemical Identifiers
| CAS Number | 77604-96-7 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C=CC(=O)C2=CC=C(O2)[N+](=O)[O-])Cl |
Product Overview
2-Propen-1-one, 3-(2-chlorophenyl)-1-(5-nitro-2-furanyl)- (CAS 77604-96-7), with molecular formula C13H8ClNO4 and molecular weight 277.01 g/mol. IUPAC: 3-(2-chlorophenyl)-1-(5-nitrofuran-2-yl)prop-2-en-1-one.
Chemical Property Profile of 2-Propen-1-one, 3-(2-chlorophenyl)-1-(5-nitro-2-furanyl)-
Property Insights of 2-Propen-1-one, 3-(2-chlorophenyl)-1-(5-nitro-2-furanyl)-
The XLogP value of 3.7373 indicates that 2-Propen-1-one, 3-(2-chlorophenyl)-1-(5-nitro-2-furanyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.35 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Propen-1-one, 3-(2-chlorophenyl)-1-(5-nitro-2-furanyl)-. Following Lipinski's Rule of Five, 2-Propen-1-one, 3-(2-chlorophenyl)-1-(5-nitro-2-furanyl)- 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-Propen-1-one, 3-(2-chlorophenyl)-1-(5-nitro-2-furanyl)-?
The CAS number of 2-Propen-1-one, 3-(2-chlorophenyl)-1-(5-nitro-2-furanyl)- is 77604-96-7.
What is the molecular formula of 2-Propen-1-one, 3-(2-chlorophenyl)-1-(5-nitro-2-furanyl)-?
The molecular formula of 2-Propen-1-one, 3-(2-chlorophenyl)-1-(5-nitro-2-furanyl)- is C13H8ClNO4.
What is the molecular weight of 2-Propen-1-one, 3-(2-chlorophenyl)-1-(5-nitro-2-furanyl)-?
The molecular weight of 2-Propen-1-one, 3-(2-chlorophenyl)-1-(5-nitro-2-furanyl)- is 277.01 g/mol.
Where can I buy 2-Propen-1-one, 3-(2-chlorophenyl)-1-(5-nitro-2-furanyl)-?
You can request a quote for 2-Propen-1-one, 3-(2-chlorophenyl)-1-(5-nitro-2-furanyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propen-1-one, 3-(2-chlorophenyl)-1-(5-nitro-2-furanyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Propen-1-one, 3-(2-chlorophenyl)-1-(5-nitro-2-furanyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.