1-((4-Amino-2-methyl-5-pyrimidinyl)methyl)-3-(2-hydroxyethyl)-2-methyl-4-nitroimidazolium

Base Information

• Chemical Name: 1-((4-Amino-2-methyl-5-pyrimidinyl)methyl)-3-(2-hydroxyethyl)-2-methyl-4-nitroimidazolium
• CAS No.: 111607-65-9
• Molecular Formula: C12H17 N6 O3
• Molecular Weight: 293.3012
• DSSTox Substance ID: DTXSID70149697
• Wikidata: Q83015556
• Mol file: 111607-65-9.mol

Synonyms:1-((4-amino-2-methyl-5-pyrimidinyl)methyl)-3-(2-hydroxyethyl)-2-methyl-4-nitroimidazolium;1-AMHN

Chemical Property of 1-((4-Amino-2-methyl-5-pyrimidinyl)methyl)-3-(2-hydroxyethyl)-2-methyl-4-nitroimidazolium

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 126.66000
• Density: g/cm³
• LogP: 0.81780
• XLogP3: -0.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 4
• Exact Mass: 293.13621343
• Heavy Atom Count: 21
• Complexity: 365

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=NC=C(C(=N1)N)C[N+]2=C(N(C(=C2)[N+](=O)[O-])CCO)C

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