Cas no 13182-87-1 (4-2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethoxy-4-oxobutanoic acid)

4-2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethoxy-4-oxobutanoic acid structure
13182-87-1 structure
Product Name:4-2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethoxy-4-oxobutanoic acid
CAS No:13182-87-1
MF:C10H13N3O6
MW:271.226722478867
CID:195694
PubChem ID:83212
Update Time:2025-04-19

4-2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethoxy-4-oxobutanoic acid Chemical and Physical Properties

Names and Identifiers

    • Butanedioic acid,1-[2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethyl] ester
    • [2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethyl] hydrogen succinate
    • 4-[2-(2-Methyl-5-nitro-1H-imidazol-1-yl)ethoxy]-4-oxobutanoic acid
    • 4-[2-(2-methyl-5-nitroimidazol-1-yl)ethoxy]-4-oxobutanoic acid
    • Einecs 236-130-1
    • Metronidazolehemisuccinate
    • metronidazole monosuccinate
    • Butanedioic acid, mono(2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethyl) ester
    • Butanedioic acid hydrogen 4-[2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethyl] ester
    • (2-(2-Methyl-5-nitro-1H-imidazol-1-yl)ethyl) hydrogen succinate
    • Metronidazolmonosuccinat
    • APPATXNXXOVPAY-UHFFFAOYSA-N
    • 13182-87-1
    • DTXSID00157220
    • FT-0682988
    • 4-(2-(2-Methyl-5-nitro-1H-imidazol-1-yl)ethoxy)-4-oxobutanoic acid
    • 4-(2-(2-Methyl-5-nitro-1H-imidazol-1-yl)ethoxy)-4-oxobutanoicacid
    • NS00024175
    • AKOS002273919
    • METRONIDAZOLE HEMISUCCINATE
    • CS-0337868
    • 4-[2-(2-Methyl-5-nitro-1h-imidazol-1-yl)ethoxy]-4-oxobutanoicacid
    • DB-195183
    • 4-2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethoxy-4-oxobutanoic acid
    • MDL: MFCD00425441
    • Inchi: 1S/C10H13N3O6/c1-7-11-6-8(13(17)18)12(7)4-5-19-10(16)3-2-9(14)15/h6H,2-5H2,1H3,(H,14,15)
    • InChI Key: APPATXNXXOVPAY-UHFFFAOYSA-N
    • SMILES: O(C(CCC(=O)O)=O)CCN1C(=CN=C1C)[N+](=O)[O-]

Computed Properties

  • Exact Mass: 271.08000
  • Monoisotopic Mass: 271.08
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 8
  • Complexity: 356
  • 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: _0.3
  • Topological Polar Surface Area: 127A^2

Experimental Properties

  • Density: 1.47
  • Boiling Point: 555.6°C at 760 mmHg
  • Flash Point: 289.8°C
  • Refractive Index: 1.596
  • PSA: 127.24000
  • LogP: 1.03090

4-2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethoxy-4-oxobutanoic acid Security Information

  • HazardClass:IRRITANT

4-2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethoxy-4-oxobutanoic acid Customs Data

  • HS CODE:2933290090
  • Customs Data:

    China Customs Code:

    2933290090

    Overview:

    2933290090. Other compounds with non fused imidazole ring in structure. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date

    Summary:

    2933290090. other compounds containing an unfused imidazole ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

4-2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethoxy-4-oxobutanoic acid Pricemore >>

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