![1-[2-(4-Nitrophenyl)-1,3-oxazinan-3-yl]ethanone structure](/static/products/3374/337494-61-8.webp)
1-[2-(4-Nitrophenyl)-1,3-oxazinan-3-yl]ethanone
TL;DR: 1-[2-(4-Nitrophenyl)-1,3-oxazinan-3-yl]ethanone (CAS 337494-61-8) is a chemical compound with molecular formula C12H14N2O4 and molecular weight 250.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(4-nitrophenyl)-1,3-oxazinan-3-yl]ethanone
Also Known As: 1-[2-(4-nitrophenyl)-1,3-oxazinan-3-yl]ethanone, 3-acetyl-2-{4-nitrophenyl}-1,3-oxazinane, AJ-292/11752008, 1-(2-(4-nitrophenyl)-1,3-oxazinan-3-yl)ethanone
| Molecular Formula | C12H14N2O4 |
|---|---|
| Molecular Weight | 250.10 g/mol |
| LogP | 1.8622 |
| Topological Polar Surface Area | 72.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 250.09535 |
| Heavy Atoms | 18 |
| Complexity | 457.65015 |
Chemical Identifiers
| CAS Number | 337494-61-8 |
|---|---|
| SMILES | CC(=O)N1CCCOC1C2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
1-[2-(4-Nitrophenyl)-1,3-oxazinan-3-yl]ethanone (CAS 337494-61-8), with molecular formula C12H14N2O4 and molecular weight 250.10 g/mol. IUPAC: 1-[2-(4-nitrophenyl)-1,3-oxazinan-3-yl]ethanone.
Chemical Property Profile of 1-[2-(4-Nitrophenyl)-1,3-oxazinan-3-yl]ethanone
Property Insights of 1-[2-(4-Nitrophenyl)-1,3-oxazinan-3-yl]ethanone
The XLogP value of 1.8622 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[2-(4-Nitrophenyl)-1,3-oxazinan-3-yl]ethanone. The TPSA of 72.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[2-(4-Nitrophenyl)-1,3-oxazinan-3-yl]ethanone. Following Lipinski's Rule of Five, 1-[2-(4-Nitrophenyl)-1,3-oxazinan-3-yl]ethanone 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 1-[2-(4-Nitrophenyl)-1,3-oxazinan-3-yl]ethanone?
The CAS number of 1-[2-(4-Nitrophenyl)-1,3-oxazinan-3-yl]ethanone is 337494-61-8.
What is the molecular formula of 1-[2-(4-Nitrophenyl)-1,3-oxazinan-3-yl]ethanone?
The molecular formula of 1-[2-(4-Nitrophenyl)-1,3-oxazinan-3-yl]ethanone is C12H14N2O4.
What is the molecular weight of 1-[2-(4-Nitrophenyl)-1,3-oxazinan-3-yl]ethanone?
The molecular weight of 1-[2-(4-Nitrophenyl)-1,3-oxazinan-3-yl]ethanone is 250.10 g/mol.
Where can I buy 1-[2-(4-Nitrophenyl)-1,3-oxazinan-3-yl]ethanone?
You can request a quote for 1-[2-(4-Nitrophenyl)-1,3-oxazinan-3-yl]ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[2-(4-Nitrophenyl)-1,3-oxazinan-3-yl]ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-[2-(4-Nitrophenyl)-1,3-oxazinan-3-yl]ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.