5-Methyl-2-(4-nitrophenyl)-4,5-dihydro-1,3-oxazole
TL;DR: 5-Methyl-2-(4-nitrophenyl)-4,5-dihydro-1,3-oxazole (CAS 832-85-9) is a chemical compound with molecular formula C10H10N2O3 and molecular weight 206.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-2-(4-nitrophenyl)-4,5-dihydro-1,3-oxazole
Also Known As: 5-methyl-2-(4-nitrophenyl)-4,5-dihydro-1,3-oxazole, 2-p-Nitrophenyl-5-methyl-2-oxazolin, 2-(4-Nitrophenyl)-5-methyl-2-oxazoline, J2.998.002K, 5-Methyl-2-(4-nitrophenyl)-4,5-dihydrooxazole
| Molecular Formula | C10H10N2O3 |
|---|---|
| Molecular Weight | 206.07 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 67.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 206.06914 |
| Heavy Atoms | 15 |
| Complexity | 277.0 |
Chemical Identifiers
| CAS Number | 832-85-9 |
|---|---|
| SMILES | CC1CN=C(O1)C2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | NCVICLUIKKDLGU-UHFFFAOYSA-N |
Product Overview
5-Methyl-2-(4-nitrophenyl)-4,5-dihydro-1,3-oxazole (CAS 832-85-9), with molecular formula C10H10N2O3 and molecular weight 206.07 g/mol. IUPAC: 5-methyl-2-(4-nitrophenyl)-4,5-dihydro-1,3-oxazole.
Chemical Property Profile of 5-Methyl-2-(4-nitrophenyl)-4,5-dihydro-1,3-oxazole
Property Insights of 5-Methyl-2-(4-nitrophenyl)-4,5-dihydro-1,3-oxazole
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Methyl-2-(4-nitrophenyl)-4,5-dihydro-1,3-oxazole. The TPSA of 67.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Methyl-2-(4-nitrophenyl)-4,5-dihydro-1,3-oxazole. Following Lipinski's Rule of Five, 5-Methyl-2-(4-nitrophenyl)-4,5-dihydro-1,3-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 5-Methyl-2-(4-nitrophenyl)-4,5-dihydro-1,3-oxazole?
The CAS number of 5-Methyl-2-(4-nitrophenyl)-4,5-dihydro-1,3-oxazole is 832-85-9.
What is the molecular formula of 5-Methyl-2-(4-nitrophenyl)-4,5-dihydro-1,3-oxazole?
The molecular formula of 5-Methyl-2-(4-nitrophenyl)-4,5-dihydro-1,3-oxazole is C10H10N2O3.
What is the molecular weight of 5-Methyl-2-(4-nitrophenyl)-4,5-dihydro-1,3-oxazole?
The molecular weight of 5-Methyl-2-(4-nitrophenyl)-4,5-dihydro-1,3-oxazole is 206.07 g/mol.
Where can I buy 5-Methyl-2-(4-nitrophenyl)-4,5-dihydro-1,3-oxazole?
You can request a quote for 5-Methyl-2-(4-nitrophenyl)-4,5-dihydro-1,3-oxazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Methyl-2-(4-nitrophenyl)-4,5-dihydro-1,3-oxazole?
Yes, KEHONG BIO provides custom synthesis services for 5-Methyl-2-(4-nitrophenyl)-4,5-dihydro-1,3-oxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.