4-Nitro-3-phenyl-1,2-oxazole
TL;DR: 4-Nitro-3-phenyl-1,2-oxazole (CAS 31301-41-4) is a chemical compound with molecular formula C9H6N2O3 and molecular weight 190.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-nitro-3-phenyl-1,2-oxazole
Also Known As: 4-nitro-3-phenyl-1,2-oxazole, 4-nitro-3-phenylisoxazole, 3-Phenyl-4-nitroisoxazole, 4-Nitro-3-phenyl-isoxazol, Isoxazole, 4-nitro-3-phenyl-
| Molecular Formula | C9H6N2O3 |
|---|---|
| Molecular Weight | 190.04 g/mol |
| LogP | 2.2498 |
| Topological Polar Surface Area | 69.17 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 190.03784 |
| Heavy Atoms | 14 |
| Complexity | 450.09045 |
Chemical Identifiers
| CAS Number | 31301-41-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NOC=C2[N+](=O)[O-] |
Product Overview
4-Nitro-3-phenyl-1,2-oxazole (CAS 31301-41-4), with molecular formula C9H6N2O3 and molecular weight 190.04 g/mol. IUPAC: 4-nitro-3-phenyl-1,2-oxazole.
Chemical Property Profile of 4-Nitro-3-phenyl-1,2-oxazole
Property Insights of 4-Nitro-3-phenyl-1,2-oxazole
The XLogP value of 2.2498 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Nitro-3-phenyl-1,2-oxazole. The TPSA of 69.17 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Nitro-3-phenyl-1,2-oxazole. Following Lipinski's Rule of Five, 4-Nitro-3-phenyl-1,2-oxazole 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 4-Nitro-3-phenyl-1,2-oxazole?
The CAS number of 4-Nitro-3-phenyl-1,2-oxazole is 31301-41-4.
What is the molecular formula of 4-Nitro-3-phenyl-1,2-oxazole?
The molecular formula of 4-Nitro-3-phenyl-1,2-oxazole is C9H6N2O3.
What is the molecular weight of 4-Nitro-3-phenyl-1,2-oxazole?
The molecular weight of 4-Nitro-3-phenyl-1,2-oxazole is 190.04 g/mol.
Where can I buy 4-Nitro-3-phenyl-1,2-oxazole?
You can request a quote for 4-Nitro-3-phenyl-1,2-oxazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Nitro-3-phenyl-1,2-oxazole?
Yes, KEHONG BIO provides custom synthesis services for 4-Nitro-3-phenyl-1,2-oxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.