3,5-Dimethyl-4-(3-nitrophenyl)-1,2-oxazole
TL;DR: 3,5-Dimethyl-4-(3-nitrophenyl)-1,2-oxazole (CAS 154822-68-1) is a chemical compound with molecular formula C11H10N2O3 and molecular weight 218.06914 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,5-dimethyl-4-(3-nitrophenyl)-1,2-oxazole
Also Known As: 3,5-dimethyl-4-(3-nitrophenyl)isoxazole, 3,5-dimethyl-4-(3-nitrophenyl)-1,2-oxazole, F0921-0674, Cambridge id 6760652
Technical Specifications
| Molecular Formula | C11H10N2O3 |
| Molecular Weight | 218.06914 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 71.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 218.06914 Da |
| Heavy Atoms | 16 |
| Complexity | 266.0 |
| SMILES | CC1=C(C(=NO1)C)C2=CC(=CC=C2)[N+](=O)[O-] |
| InChIKey | SVYXGIQNGFCMOT-UHFFFAOYSA-N |
Chemical Property Profile of 3,5-Dimethyl-4-(3-nitrophenyl)-1,2-oxazole
Property Insights of 3,5-Dimethyl-4-(3-nitrophenyl)-1,2-oxazole
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5-Dimethyl-4-(3-nitrophenyl)-1,2-oxazole. The TPSA of 71.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,5-Dimethyl-4-(3-nitrophenyl)-1,2-oxazole. Following Lipinski's Rule of Five, 3,5-Dimethyl-4-(3-nitrophenyl)-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
What is the CAS number of 3,5-Dimethyl-4-(3-nitrophenyl)-1,2-oxazole?
The CAS number of 3,5-Dimethyl-4-(3-nitrophenyl)-1,2-oxazole is 154822-68-1.
What is the molecular formula of 3,5-Dimethyl-4-(3-nitrophenyl)-1,2-oxazole?
The molecular formula of 3,5-Dimethyl-4-(3-nitrophenyl)-1,2-oxazole is C11H10N2O3.
What is the molecular weight of 3,5-Dimethyl-4-(3-nitrophenyl)-1,2-oxazole?
The molecular weight of 3,5-Dimethyl-4-(3-nitrophenyl)-1,2-oxazole is 218.06914 g/mol.
Where can I buy 3,5-Dimethyl-4-(3-nitrophenyl)-1,2-oxazole?
You can request a quote for 3,5-Dimethyl-4-(3-nitrophenyl)-1,2-oxazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3,5-Dimethyl-4-(3-nitrophenyl)-1,2-oxazole?
Yes, CoreyChem provides custom synthesis services for 3,5-Dimethyl-4-(3-nitrophenyl)-1,2-oxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.