2-Nitrosooxazinane
TL;DR: 2-Nitrosooxazinane (CAS 40548-68-3) is a chemical compound with molecular formula C4H8N2O2 and molecular weight 116.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-nitrosooxazinane
Also Known As: 2-nitrosooxazinane, 2-nitroso-1,2-oxazinane, N-Nitrosotetrahydro-1,2-oxazin, nitrosotetrahydrooxazine, Tetrahydro-2-nitroso-2H-1,2-oxazine
| Molecular Formula | C4H8N2O2 |
|---|---|
| Molecular Weight | 116.06 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 41.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 116.05858 |
| Heavy Atoms | 8 |
| Complexity | 86.0 |
Chemical Identifiers
| CAS Number | 40548-68-3 |
|---|---|
| SMILES | C1CCON(C1)N=O |
| InChIKey | PREXGTBZMLDXHV-UHFFFAOYSA-N |
Product Overview
2-Nitrosooxazinane (CAS 40548-68-3), with molecular formula C4H8N2O2 and molecular weight 116.06 g/mol. IUPAC: 2-nitrosooxazinane.
Chemical Property Profile of 2-Nitrosooxazinane
Property Insights of 2-Nitrosooxazinane
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Nitrosooxazinane. With a topological polar surface area (TPSA) of 41.9 Ų, 2-Nitrosooxazinane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Nitrosooxazinane 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 2-Nitrosooxazinane?
The CAS number of 2-Nitrosooxazinane is 40548-68-3.
What is the molecular formula of 2-Nitrosooxazinane?
The molecular formula of 2-Nitrosooxazinane is C4H8N2O2.
What is the molecular weight of 2-Nitrosooxazinane?
The molecular weight of 2-Nitrosooxazinane is 116.06 g/mol.
Where can I buy 2-Nitrosooxazinane?
You can request a quote for 2-Nitrosooxazinane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Nitrosooxazinane?
Yes, KEHONG BIO provides custom synthesis services for 2-Nitrosooxazinane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.