Cas no 1215071-08-1 (Hydroxy Metronidazole-d4)

Hydroxy Metronidazole-d4 structure
Hydroxy Metronidazole-d4 structure
Product Name:Hydroxy Metronidazole-d4
CAS No:1215071-08-1
MF:C6H9N3O4
MW:191.17800784111
CID:1062448
PubChem ID:53394718
Update Time:2025-04-20

Hydroxy Metronidazole-d4 Chemical and Physical Properties

Names and Identifiers

    • Hydroxy Metronidazole-d4
    • 1,1,2,2-tetradeuterio-2-[2-(hydroxymethyl)-5-nitroimidazol-1-yl]ethanol
    • Hydroxymetronidazole-d4
    • 2-[2-(hydroxymethyl)-5-nitro-1H-imidazol-1-yl](?H?)ethan-1-ol
    • HY-136440S
    • 1215071-08-1
    • DTXSID70694036
    • J-004510
    • 2-[2-(Hydroxymethyl)-5-nitro-1H-imidazol-1-yl](~2~H_4_)ethan-1-ol
    • CS-0203566
    • G13967
    • Inchi: 1S/C6H9N3O4/c10-2-1-8-5(4-11)7-3-6(8)9(12)13/h3,10-11H,1-2,4H2/i1D2,2D2
    • InChI Key: AEHPOYAOLCAMIU-LNLMKGTHSA-N
    • SMILES: OC([2H])([2H])C([2H])([2H])N1C(=CN=C1CO)[N+](=O)[O-]

Computed Properties

  • Exact Mass: 191.08400
  • Monoisotopic Mass: 191.08441276g/mol
  • Isotope Atom Count: 4
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 3
  • Complexity: 183
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -1.3
  • Topological Polar Surface Area: 104?2

Experimental Properties

  • Melting Point: 118-120°C
  • PSA: 104.10000
  • LogP: -0.20090

Hydroxy Metronidazole-d4 Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
H948397-1mg
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$ 219.00 2023-09-07
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AN HUI ZE SHENG Technology Co., Ltd.
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2-(2-(hydroxymethyl)-5-nitro-1h-imidazol-1-yl)ethan-1,1,2,2-d4-1-ol
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ChemScence
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$0.0 2022-04-28
ChemScence
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