6-Nitro-3-p-nitrophenylchromen-2-one
TL;DR: 6-Nitro-3-p-nitrophenylchromen-2-one (CAS 22131-84-6) is a chemical compound with molecular formula C15H8N2O6 and molecular weight 312.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-nitro-3-(4-nitrophenyl)chromen-2-one
Also Known As: 6-Nitro-3-p-nitrophenylchromen-2-one, 6,4'-Dinitro-3-phenyl-cumarin, 6-nitro-3-(4-nitrophenyl)chromen-2-one, 6-nitro-3-(4-nitrophenyl)-2H-chromen-2-one, 6-Nitro-3-(4-nitrophenyl)-2H-1-benzopyran-2-one
| Molecular Formula | C15H8N2O6 |
|---|---|
| Molecular Weight | 312.04 g/mol |
| LogP | 3.2764 |
| Topological Polar Surface Area | 116.49 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 312.03824 |
| Heavy Atoms | 23 |
| Complexity | 991.0149 |
Chemical Identifiers
| CAS Number | 22131-84-6 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=CC3=C(C=CC(=C3)[N+](=O)[O-])OC2=O)[N+](=O)[O-] |
Product Overview
6-Nitro-3-p-nitrophenylchromen-2-one (CAS 22131-84-6), with molecular formula C15H8N2O6 and molecular weight 312.04 g/mol. IUPAC: 6-nitro-3-(4-nitrophenyl)chromen-2-one.
Chemical Property Profile of 6-Nitro-3-p-nitrophenylchromen-2-one
Property Insights of 6-Nitro-3-p-nitrophenylchromen-2-one
The XLogP value of 3.2764 indicates that 6-Nitro-3-p-nitrophenylchromen-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.49 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Nitro-3-p-nitrophenylchromen-2-one. Following Lipinski's Rule of Five, 6-Nitro-3-p-nitrophenylchromen-2-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
Frequently Asked Questions
What is the CAS number of 6-Nitro-3-p-nitrophenylchromen-2-one?
The CAS number of 6-Nitro-3-p-nitrophenylchromen-2-one is 22131-84-6.
What is the molecular formula of 6-Nitro-3-p-nitrophenylchromen-2-one?
The molecular formula of 6-Nitro-3-p-nitrophenylchromen-2-one is C15H8N2O6.
What is the molecular weight of 6-Nitro-3-p-nitrophenylchromen-2-one?
The molecular weight of 6-Nitro-3-p-nitrophenylchromen-2-one is 312.04 g/mol.
Where can I buy 6-Nitro-3-p-nitrophenylchromen-2-one?
You can request a quote for 6-Nitro-3-p-nitrophenylchromen-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Nitro-3-p-nitrophenylchromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 6-Nitro-3-p-nitrophenylchromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.