2H-1,3-Oxazine, tetrahydro-3,5-dimethyl-5-nitro-, hydrochloride
TL;DR: 2H-1,3-Oxazine, tetrahydro-3,5-dimethyl-5-nitro-, hydrochloride (CAS 6951-60-6) is a chemical compound with molecular formula C6H13ClN2O3 and molecular weight 196.06 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;hydrochloride
Also Known As: T 398, 2H-1,3-Oxazine, tetrahydro-3,5-dimethyl-5-nitro-, hydrochloride, 3,5-Dimethyl-5-nitrotetrahydro-2H-1,3-oxazine hydrochloride, 3,5-dimethyl-5-nitro-1,3-oxazinane hydrochloride, 3,5-dimethyl-5-nitro-1,3-oxazinane,hydrochloride
| Molecular Formula | C6H13ClN2O3 |
|---|---|
| Molecular Weight | 196.06 g/mol |
| LogP | 0.3631 |
| Topological Polar Surface Area | 58.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 196.06146 |
| Heavy Atoms | 12 |
| Complexity | 168.0 |
Chemical Identifiers
| CAS Number | 6951-60-6 |
|---|---|
| SMILES | CC1(CN(COC1)C)[N+](=O)[O-].Cl |
| InChIKey | ZKTCGLMXIOXGND-UHFFFAOYSA-N |
Product Overview
2H-1,3-Oxazine, tetrahydro-3,5-dimethyl-5-nitro-, hydrochloride (CAS 6951-60-6), with molecular formula C6H13ClN2O3 and molecular weight 196.06 g/mol. IUPAC: 3,5-dimethyl-5-nitro-1,3-oxazinane;hydrochloride.
Chemical Property Profile of 2H-1,3-Oxazine, tetrahydro-3,5-dimethyl-5-nitro-, hydrochloride
Property Insights of 2H-1,3-Oxazine, tetrahydro-3,5-dimethyl-5-nitro-, hydrochloride
The XLogP value of 0.3631 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H-1,3-Oxazine, tetrahydro-3,5-dimethyl-5-nitro-, hydrochloride. With a topological polar surface area (TPSA) of 58.3 Ų, 2H-1,3-Oxazine, tetrahydro-3,5-dimethyl-5-nitro-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-1,3-Oxazine, tetrahydro-3,5-dimethyl-5-nitro-, hydrochloride has 1 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 2H-1,3-Oxazine, tetrahydro-3,5-dimethyl-5-nitro-, hydrochloride?
The CAS number of 2H-1,3-Oxazine, tetrahydro-3,5-dimethyl-5-nitro-, hydrochloride is 6951-60-6.
What is the molecular formula of 2H-1,3-Oxazine, tetrahydro-3,5-dimethyl-5-nitro-, hydrochloride?
The molecular formula of 2H-1,3-Oxazine, tetrahydro-3,5-dimethyl-5-nitro-, hydrochloride is C6H13ClN2O3.
What is the molecular weight of 2H-1,3-Oxazine, tetrahydro-3,5-dimethyl-5-nitro-, hydrochloride?
The molecular weight of 2H-1,3-Oxazine, tetrahydro-3,5-dimethyl-5-nitro-, hydrochloride is 196.06 g/mol.
Where can I buy 2H-1,3-Oxazine, tetrahydro-3,5-dimethyl-5-nitro-, hydrochloride?
You can request a quote for 2H-1,3-Oxazine, tetrahydro-3,5-dimethyl-5-nitro-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-1,3-Oxazine, tetrahydro-3,5-dimethyl-5-nitro-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 2H-1,3-Oxazine, tetrahydro-3,5-dimethyl-5-nitro-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.