7-(2,4-dinitrophenoxy)-4-methyl-2H-chromen-2-one
TL;DR: 7-(2,4-dinitrophenoxy)-4-methyl-2H-chromen-2-one (CAS 314742-00-2) is a chemical compound with molecular formula C16H10N2O7 and molecular weight 342.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(2,4-dinitrophenoxy)-4-methylchromen-2-one
Also Known As: 7-(2,4-dinitrophenoxy)-4-methyl-2H-chromen-2-one, 7-(2,4-dinitrophenoxy)-4-methylchromen-2-one, BAS 00872268, 7-(2,4-Dinitro-phenoxy)-4-methyl-chromen-2-one, 7-(2,4-dinitrophenoxy)-4-methyl-2H-1-benzopyran-2-one
| Molecular Formula | C16H10N2O7 |
|---|---|
| Molecular Weight | 342.05 g/mol |
| LogP | 3.71012 |
| Topological Polar Surface Area | 125.72 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 342.0488 |
| Heavy Atoms | 25 |
| Complexity | 1071.7566 |
Chemical Identifiers
| CAS Number | 314742-00-2 |
|---|---|
| SMILES | CC1=CC(=O)OC2=C1C=CC(=C2)OC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
7-(2,4-dinitrophenoxy)-4-methyl-2H-chromen-2-one (CAS 314742-00-2), with molecular formula C16H10N2O7 and molecular weight 342.05 g/mol. IUPAC: 7-(2,4-dinitrophenoxy)-4-methylchromen-2-one.
Chemical Property Profile of 7-(2,4-dinitrophenoxy)-4-methyl-2H-chromen-2-one
Property Insights of 7-(2,4-dinitrophenoxy)-4-methyl-2H-chromen-2-one
The XLogP value of 3.71012 indicates that 7-(2,4-dinitrophenoxy)-4-methyl-2H-chromen-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 125.72 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-(2,4-dinitrophenoxy)-4-methyl-2H-chromen-2-one. Following Lipinski's Rule of Five, 7-(2,4-dinitrophenoxy)-4-methyl-2H-chromen-2-one has 0 hydrogen bond donor(s) and 7 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 7-(2,4-dinitrophenoxy)-4-methyl-2H-chromen-2-one?
The CAS number of 7-(2,4-dinitrophenoxy)-4-methyl-2H-chromen-2-one is 314742-00-2.
What is the molecular formula of 7-(2,4-dinitrophenoxy)-4-methyl-2H-chromen-2-one?
The molecular formula of 7-(2,4-dinitrophenoxy)-4-methyl-2H-chromen-2-one is C16H10N2O7.
What is the molecular weight of 7-(2,4-dinitrophenoxy)-4-methyl-2H-chromen-2-one?
The molecular weight of 7-(2,4-dinitrophenoxy)-4-methyl-2H-chromen-2-one is 342.05 g/mol.
Where can I buy 7-(2,4-dinitrophenoxy)-4-methyl-2H-chromen-2-one?
You can request a quote for 7-(2,4-dinitrophenoxy)-4-methyl-2H-chromen-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-(2,4-dinitrophenoxy)-4-methyl-2H-chromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 7-(2,4-dinitrophenoxy)-4-methyl-2H-chromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.