2-(4-Chloro-3-nitrophenyl)chromen-4-one
TL;DR: 2-(4-Chloro-3-nitrophenyl)chromen-4-one (CAS 92429-17-9) is a chemical compound with molecular formula C15H8ClNO4 and molecular weight 301.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chloro-3-nitrophenyl)chromen-4-one
Also Known As: 2-(4-Chloro-3-nitrophenyl)chromen-4-one, 4'-Chloro-3'-nitroflavone, 3'-Nitrate-4'-chloroflavanone, 3 -Nitro-4 -chloroflavone, 4 -Chloro-3 -nitroflavone
| Molecular Formula | C15H8ClNO4 |
|---|---|
| Molecular Weight | 301.01 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 72.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 301.0142 |
| Heavy Atoms | 21 |
| Complexity | 473.0 |
Chemical Identifiers
| CAS Number | 92429-17-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C=C(O2)C3=CC(=C(C=C3)Cl)[N+](=O)[O-] |
| InChIKey | YDQBNIDWVWSZQA-UHFFFAOYSA-N |
Product Overview
2-(4-Chloro-3-nitrophenyl)chromen-4-one (CAS 92429-17-9), with molecular formula C15H8ClNO4 and molecular weight 301.01 g/mol. IUPAC: 2-(4-chloro-3-nitrophenyl)chromen-4-one.
Chemical Property Profile of 2-(4-Chloro-3-nitrophenyl)chromen-4-one
Property Insights of 2-(4-Chloro-3-nitrophenyl)chromen-4-one
The XLogP value of 4.0 indicates that 2-(4-Chloro-3-nitrophenyl)chromen-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Chloro-3-nitrophenyl)chromen-4-one. Following Lipinski's Rule of Five, 2-(4-Chloro-3-nitrophenyl)chromen-4-one 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-Chloro-3-nitrophenyl)chromen-4-one?
The CAS number of 2-(4-Chloro-3-nitrophenyl)chromen-4-one is 92429-17-9.
What is the molecular formula of 2-(4-Chloro-3-nitrophenyl)chromen-4-one?
The molecular formula of 2-(4-Chloro-3-nitrophenyl)chromen-4-one is C15H8ClNO4.
What is the molecular weight of 2-(4-Chloro-3-nitrophenyl)chromen-4-one?
The molecular weight of 2-(4-Chloro-3-nitrophenyl)chromen-4-one is 301.01 g/mol.
Where can I buy 2-(4-Chloro-3-nitrophenyl)chromen-4-one?
You can request a quote for 2-(4-Chloro-3-nitrophenyl)chromen-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Chloro-3-nitrophenyl)chromen-4-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Chloro-3-nitrophenyl)chromen-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.