3,5-Dimethyl-5-nitro-1,3-oxazinane
TL;DR: 3,5-Dimethyl-5-nitro-1,3-oxazinane (CAS 875-09-2) is a chemical compound with molecular formula C6H12N2O3 and molecular weight 160.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dimethyl-5-nitro-1,3-oxazinane
Also Known As: 3,5-dimethyl-5-nitro-1,3-oxazinane, 3,5-dimethyl-5-nitro-[1,3]oxazinane, T 398
| Molecular Formula | C6H12N2O3 |
|---|---|
| Molecular Weight | 160.08 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 58.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 160.0848 |
| Heavy Atoms | 11 |
| Complexity | 168.0 |
Chemical Identifiers
| CAS Number | 875-09-2 |
|---|---|
| SMILES | CC1(CN(COC1)C)[N+](=O)[O-] |
| InChIKey | NEACXASRQZHDPP-UHFFFAOYSA-N |
Product Overview
3,5-Dimethyl-5-nitro-1,3-oxazinane (CAS 875-09-2), with molecular formula C6H12N2O3 and molecular weight 160.08 g/mol. IUPAC: 3,5-dimethyl-5-nitro-1,3-oxazinane.
Chemical Property Profile of 3,5-Dimethyl-5-nitro-1,3-oxazinane
Property Insights of 3,5-Dimethyl-5-nitro-1,3-oxazinane
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5-Dimethyl-5-nitro-1,3-oxazinane. With a topological polar surface area (TPSA) of 58.3 Ų, 3,5-Dimethyl-5-nitro-1,3-oxazinane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-Dimethyl-5-nitro-1,3-oxazinane 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 3,5-Dimethyl-5-nitro-1,3-oxazinane?
The CAS number of 3,5-Dimethyl-5-nitro-1,3-oxazinane is 875-09-2.
What is the molecular formula of 3,5-Dimethyl-5-nitro-1,3-oxazinane?
The molecular formula of 3,5-Dimethyl-5-nitro-1,3-oxazinane is C6H12N2O3.
What is the molecular weight of 3,5-Dimethyl-5-nitro-1,3-oxazinane?
The molecular weight of 3,5-Dimethyl-5-nitro-1,3-oxazinane is 160.08 g/mol.
Where can I buy 3,5-Dimethyl-5-nitro-1,3-oxazinane?
You can request a quote for 3,5-Dimethyl-5-nitro-1,3-oxazinane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Dimethyl-5-nitro-1,3-oxazinane?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Dimethyl-5-nitro-1,3-oxazinane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.