alpha-(1-Aziridinylmethyl)-2-methyl-4-nitro-1H-imidazole-1-ethanol

Base Information

• Chemical Name: alpha-(1-Aziridinylmethyl)-2-methyl-4-nitro-1H-imidazole-1-ethanol
• CAS No.: 105027-79-0
• Molecular Formula: C9H14 N4 O3
• Molecular Weight: 226.235
• DSSTox Substance ID: DTXSID00909307
• Mol file: 105027-79-0.mol

Synonyms:105027-79-0;alpha-(1-Aziridinylmethyl)-2-methyl-4-nitro-1H-imidazole-1-ethanol;1-(aziridin-1-yl)-3-(2-methyl-4-nitroimidazol-1-yl)propan-2-ol;RSU 1170;1H-Imidazole-1-ethanol, alpha-(1-aziridinylmethyl)-2-methyl-4-nitro-;DTXSID00909307;1-(Aziridin-1-yl)-3-(2-methyl-4-nitro-1H-imidazol-1-yl)propan-2-ol

Chemical Property of alpha-(1-Aziridinylmethyl)-2-methyl-4-nitro-1H-imidazole-1-ethanol

Chemical Property:

• Vapor Pressure: 6.8E-10mmHg at 25°C
• Boiling Point: 476.7°C at 760 mmHg
• Flash Point: 242.1°C
• PSA: 86.88000
• Density: 1.52g/cm³
• LogP: 0.23730
• XLogP3: -0.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 226.10659032
• Heavy Atom Count: 16
• Complexity: 266

Purity/Quality:

RSU-1170 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=NC(=CN1CC(CN2CC2)O)[N+](=O)[O-]