2H-1,3,4-Oxadiazinium, tetrahydro-4,4-dimethyl-2-oxo-, chloride
TL;DR: 2H-1,3,4-Oxadiazinium, tetrahydro-4,4-dimethyl-2-oxo-, chloride (CAS 63867-32-3) is a chemical compound with molecular formula C5H11ClN2O2 and molecular weight 166.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4-dimethyl-1,3,4-oxadiazinan-4-ium-2-one chloride
Also Known As: 2H-1,3,4-Oxadiazinium, tetrahydro-4,4-dimethyl-2-oxo-, chloride, 4,4-dimethyl-2-oxo-1,3,4-oxadiazinan-4-ium chloride, 2-Keto-4,4-dimethyl-2,3,5,6-tetrahydro-1,3,4-oxadiazinium chloride, 4,4-dimethyl-1,3,4-oxadiazinan-4-ium-2-one chloride, RefChem:1064986
| Molecular Formula | C5H11ClN2O2 |
|---|---|
| Molecular Weight | 166.05 g/mol |
| LogP | -3.28 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 166.0509 |
| Heavy Atoms | 10 |
| Complexity | 133.0 |
Chemical Identifiers
| CAS Number | 63867-32-3 |
|---|---|
| SMILES | C[N+]1(CCOC(=O)N1)C.[Cl-] |
| InChIKey | SLFHGQHIYNVZKL-UHFFFAOYSA-N |
Product Overview
2H-1,3,4-Oxadiazinium, tetrahydro-4,4-dimethyl-2-oxo-, chloride (CAS 63867-32-3), with molecular formula C5H11ClN2O2 and molecular weight 166.05 g/mol. IUPAC: 4,4-dimethyl-1,3,4-oxadiazinan-4-ium-2-one chloride.
Chemical Property Profile of 2H-1,3,4-Oxadiazinium, tetrahydro-4,4-dimethyl-2-oxo-, chloride
Property Insights of 2H-1,3,4-Oxadiazinium, tetrahydro-4,4-dimethyl-2-oxo-, chloride
The XLogP value of -3.28 indicates that 2H-1,3,4-Oxadiazinium, tetrahydro-4,4-dimethyl-2-oxo-, chloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 38.3 Ų, 2H-1,3,4-Oxadiazinium, tetrahydro-4,4-dimethyl-2-oxo-, chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-1,3,4-Oxadiazinium, tetrahydro-4,4-dimethyl-2-oxo-, chloride has 1 hydrogen bond donor(s) and 3 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-1,3,4-Oxadiazinium, tetrahydro-4,4-dimethyl-2-oxo-, chloride?
The CAS number of 2H-1,3,4-Oxadiazinium, tetrahydro-4,4-dimethyl-2-oxo-, chloride is 63867-32-3.
What is the molecular formula of 2H-1,3,4-Oxadiazinium, tetrahydro-4,4-dimethyl-2-oxo-, chloride?
The molecular formula of 2H-1,3,4-Oxadiazinium, tetrahydro-4,4-dimethyl-2-oxo-, chloride is C5H11ClN2O2.
What is the molecular weight of 2H-1,3,4-Oxadiazinium, tetrahydro-4,4-dimethyl-2-oxo-, chloride?
The molecular weight of 2H-1,3,4-Oxadiazinium, tetrahydro-4,4-dimethyl-2-oxo-, chloride is 166.05 g/mol.
Where can I buy 2H-1,3,4-Oxadiazinium, tetrahydro-4,4-dimethyl-2-oxo-, chloride?
You can request a quote for 2H-1,3,4-Oxadiazinium, tetrahydro-4,4-dimethyl-2-oxo-, chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-1,3,4-Oxadiazinium, tetrahydro-4,4-dimethyl-2-oxo-, chloride?
Yes, KEHONG BIO provides custom synthesis services for 2H-1,3,4-Oxadiazinium, tetrahydro-4,4-dimethyl-2-oxo-, chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.