4-甲基-1H-咪唑-1-醇3-氧化物
TL;DR: 4-甲基-1H-咪唑-1-醇3-氧化物 (CAS 24374-38-7) is a chemical compound with molecular formula C4H6N2O2 and molecular weight 114.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-甲基-1H-咪唑-1-醇3-氧化物
1-hydroxy-4-methyl-3-oxidoimidazol-3-ium
Also Known As: 4-methyl-1h-imidazol-1-ol 3-oxide, 4-methylimidazole-1,3-diol, 1-hydroxy-4-methylimidazole3-oxide, 1-Hydroxy-4-methyl-1H-imidazole 3-oxide, 1-hydroxy-4-methyl-3-oxidoimidazol-3-ium
| Molecular Formula | C4H6N2O2 |
|---|---|
| Molecular Weight | 114.04 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 50.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 114.04293 |
| Heavy Atoms | 8 |
| Complexity | 88.0 |
Chemical Identifiers
| CAS Number | 24374-38-7 |
|---|---|
| SMILES | CC1=CN(C=[N+]1[O-])O |
| InChIKey | VYNJQZZELSAPLR-UHFFFAOYSA-N |
Product Overview
4-甲基-1H-咪唑-1-醇3-氧化物 (CAS 24374-38-7), with molecular formula C4H6N2O2 and molecular weight 114.04 g/mol. IUPAC: 1-hydroxy-4-methyl-3-oxidoimidazol-3-ium.
Chemical Property Profile of 4-甲基-1H-咪唑-1-醇3-氧化物
Property Insights of 4-甲基-1H-咪唑-1-醇3-氧化物
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-甲基-1H-咪唑-1-醇3-氧化物. With a topological polar surface area (TPSA) of 50.6 Ų, 4-甲基-1H-咪唑-1-醇3-氧化物 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-甲基-1H-咪唑-1-醇3-氧化物 has 1 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 4-甲基-1H-咪唑-1-醇3-氧化物?
The CAS number of 4-甲基-1H-咪唑-1-醇3-氧化物 is 24374-38-7.
What is the molecular formula of 4-甲基-1H-咪唑-1-醇3-氧化物?
The molecular formula of 4-甲基-1H-咪唑-1-醇3-氧化物 is C4H6N2O2.
What is the molecular weight of 4-甲基-1H-咪唑-1-醇3-氧化物?
The molecular weight of 4-甲基-1H-咪唑-1-醇3-氧化物 is 114.04 g/mol.
Where can I buy 4-甲基-1H-咪唑-1-醇3-氧化物?
You can request a quote for 4-甲基-1H-咪唑-1-醇3-氧化物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-甲基-1H-咪唑-1-醇3-氧化物?
Yes, KEHONG BIO provides custom synthesis services for 4-甲基-1H-咪唑-1-醇3-氧化物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.