2,2,4-Trimethyl-2H-imidazole 1-oxide
TL;DR: 2,2,4-Trimethyl-2H-imidazole 1-oxide (CAS 136440-22-7) is a chemical compound with molecular formula C6H10N2O and molecular weight 126.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,4-trimethyl-1-oxidoimidazol-1-ium
Also Known As: TMIO, 2,2,4-Trimethyl-2H-imidazole 1-oxide, 2,2,4-trimethyl-1-oxidoimidazol-1-ium, 2,2,4-Trimethyl-2h-imidazole-1-oxide, AmbscL02/026-L09/041C
| Molecular Formula | C6H10N2O |
|---|---|
| Molecular Weight | 126.08 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 41.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 126.079315 |
| Heavy Atoms | 9 |
| Complexity | 191.0 |
Chemical Identifiers
| CAS Number | 136440-22-7 |
|---|---|
| SMILES | CC1=NC([N+](=C1)[O-])(C)C |
| InChIKey | CNIGTNPXWSLRPH-UHFFFAOYSA-N |
Product Overview
2,2,4-Trimethyl-2H-imidazole 1-oxide (CAS 136440-22-7), with molecular formula C6H10N2O and molecular weight 126.08 g/mol. IUPAC: 2,2,4-trimethyl-1-oxidoimidazol-1-ium.
Chemical Property Profile of 2,2,4-Trimethyl-2H-imidazole 1-oxide
Property Insights of 2,2,4-Trimethyl-2H-imidazole 1-oxide
The XLogP value of -0.5 indicates that 2,2,4-Trimethyl-2H-imidazole 1-oxide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 41.1 Ų, 2,2,4-Trimethyl-2H-imidazole 1-oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2,4-Trimethyl-2H-imidazole 1-oxide 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 2,2,4-Trimethyl-2H-imidazole 1-oxide?
The CAS number of 2,2,4-Trimethyl-2H-imidazole 1-oxide is 136440-22-7.
What is the molecular formula of 2,2,4-Trimethyl-2H-imidazole 1-oxide?
The molecular formula of 2,2,4-Trimethyl-2H-imidazole 1-oxide is C6H10N2O.
What is the molecular weight of 2,2,4-Trimethyl-2H-imidazole 1-oxide?
The molecular weight of 2,2,4-Trimethyl-2H-imidazole 1-oxide is 126.08 g/mol.
Where can I buy 2,2,4-Trimethyl-2H-imidazole 1-oxide?
You can request a quote for 2,2,4-Trimethyl-2H-imidazole 1-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2,4-Trimethyl-2H-imidazole 1-oxide?
Yes, KEHONG BIO provides custom synthesis services for 2,2,4-Trimethyl-2H-imidazole 1-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.