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Home > Encyclopedia > 5-iodo-1-(2-nitro-1H-imidazol-5-yl)pent-4-en-2-ol

5-iodo-1-(2-nitro-1H-imidazol-5-yl)pent-4-en-2-ol

5-iodo-1-(2-nitro-1H-imidazol-5-yl)pent-4-en-2-ol structure

5-iodo-1-(2-nitro-1H-imidazol-5-yl)pent-4-en-2-ol 

structure
  • CAS No:

    133933-39-8

  • Formula:

    C8H10IN3O3

  • Chemical Name:

    5-iodo-1-(2-nitro-1H-imidazol-5-yl)pent-4-en-2-ol

  • Synonyms:

    5-(2-Nitroimidazolyl)-4-hydroxy-1-iodopent-1-ene; 1H-Imidazole-1-ethanol,a-(3-iodo-2-propenyl)-2-nitro-,[S-(E)]-(9CI); (iodovinyl)misonidazole;

  • Categories:

    Organic Chemistry  >  Nitro Compounds

5-iodo-1-(2-nitro-1H-imidazol-5-yl)pent-4-en-2-ol Basic Attributes

323.08800

322.97669

Characteristics

94.73000

2.08330

1.91g/cm3

468.8ºC

237.3ºC

1.67

1.37E-09mmHg at 25°C

Drug Information

5-(2-nitroimidazolyl)-4-hydroxy-1-iodopent-1-ene

Computed Properties

Molecular Weight:323.09
XLogP3:1.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:322.97669
Monoisotopic Mass:322.97669
Topological Polar Surface Area:83.9
Heavy Atom Count:15
Complexity:244
Undefined Atom Stereocenter Count:1
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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