3,3,4,4-Tetramethyl-1-oxido-diazet-1-ium
TL;DR: 3,3,4,4-Tetramethyl-1-oxido-diazet-1-ium (CAS 40543-89-3) is a chemical compound with molecular formula C6H12N2O and molecular weight 128.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3,4,4-tetramethyl-1-oxidodiazet-1-ium
Also Known As: 3,3,4,4-Tetramethyldiazetin-1-oxid, 3,3,4,4-tetramethyl-1-oxidodiazet-1-ium, 3,3,4,4-tetramethyl-1-oxido-diazet-1-ium, NCI60_032902, 3,3,4,4-tetramethyl-1,2-diazetine-N-oxide
| Molecular Formula | C6H12N2O |
|---|---|
| Molecular Weight | 128.09 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 41.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 128.09496 |
| Heavy Atoms | 9 |
| Complexity | 170.0 |
Chemical Identifiers
| CAS Number | 40543-89-3 |
|---|---|
| SMILES | CC1(C([N+](=N1)[O-])(C)C)C |
| InChIKey | UDCUFMUYRZOCTR-UHFFFAOYSA-N |
Product Overview
3,3,4,4-Tetramethyl-1-oxido-diazet-1-ium (CAS 40543-89-3), with molecular formula C6H12N2O and molecular weight 128.09 g/mol. IUPAC: 3,3,4,4-tetramethyl-1-oxidodiazet-1-ium.
Chemical Property Profile of 3,3,4,4-Tetramethyl-1-oxido-diazet-1-ium
Property Insights of 3,3,4,4-Tetramethyl-1-oxido-diazet-1-ium
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3,4,4-Tetramethyl-1-oxido-diazet-1-ium. With a topological polar surface area (TPSA) of 41.1 Ų, 3,3,4,4-Tetramethyl-1-oxido-diazet-1-ium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3,4,4-Tetramethyl-1-oxido-diazet-1-ium has 0 hydrogen bond donor(s) and 2 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 3,3,4,4-Tetramethyl-1-oxido-diazet-1-ium?
The CAS number of 3,3,4,4-Tetramethyl-1-oxido-diazet-1-ium is 40543-89-3.
What is the molecular formula of 3,3,4,4-Tetramethyl-1-oxido-diazet-1-ium?
The molecular formula of 3,3,4,4-Tetramethyl-1-oxido-diazet-1-ium is C6H12N2O.
What is the molecular weight of 3,3,4,4-Tetramethyl-1-oxido-diazet-1-ium?
The molecular weight of 3,3,4,4-Tetramethyl-1-oxido-diazet-1-ium is 128.09 g/mol.
Where can I buy 3,3,4,4-Tetramethyl-1-oxido-diazet-1-ium?
You can request a quote for 3,3,4,4-Tetramethyl-1-oxido-diazet-1-ium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3,4,4-Tetramethyl-1-oxido-diazet-1-ium?
Yes, KEHONG BIO provides custom synthesis services for 3,3,4,4-Tetramethyl-1-oxido-diazet-1-ium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.