Cas no 108-26-9 (3-Methyl-1H-pyrazol-5(4H)-one)

3-Methyl-1H-pyrazol-5(4H)-one structure
3-Methyl-1H-pyrazol-5(4H)-one structure
Product Name:3-Methyl-1H-pyrazol-5(4H)-one
CAS No:108-26-9
MF:C4H6N2O
MW:98.1032404899597
MDL:MFCD00020699
CID:35483
PubChem ID:7920
Update Time:2025-04-18

3-Methyl-1H-pyrazol-5(4H)-one Chemical and Physical Properties

Names and Identifiers

    • 3-Methyl-1H-pyrazol-5(4H)-one
    • 3-Methyl-2-pyrazolin-5-one
    • 3-methyl pyrazole-5-one
    • 3-Methyl-5-pyrazolone
    • 2,4-Dihydro-5-methyl-3H-pyrazol-3-one
    • 3-methyl-1,4-dihydropyrazol-5-one
    • Nickel(II) sulfate heptahydrate
    • 5-Methyl-2,4-dihydro-pyrazol-3-one
    • AURORA KA-6219
    • TIMTEC-BB SBB004372
    • Methyl-5-pyrazolone
    • 3-Methyl-pyrazolon-(5)
    • 3-methyl-2-pyrazolin-5-on
    • 5-Methyl-3H-pyrazol-3-one
    • 3-METHYL-5-PYRAZOLONE 98+%
    • 5-methyl-2,4-dihydropyrazol-3-one
    • NSC 4120
    • 3-methyl-2-pyrazoline-5-one
    • EINECS 203-565-3
    • CS-W013724
    • FT-0616077
    • E83006
    • J-512869
    • AKOS003624833
    • DTXSID2051554
    • AC-4810
    • AKOS025243276
    • 3-methyl-1H-pyrazoline-5-one
    • Q27286078
    • 3Me5Oxopyrazol
    • NSC4120
    • NS00002624
    • 3-Methyl-5-pyrazolone, Lonza quality, 99.0-100.3% (w/w) (T)
    • AC8022
    • 5-Methyl-2,4-dihydro-3H-pyrazol-3-one
    • 3H-Pyrazol-3-one, 2,4-dihydro-5-methyl-
    • EC 203-565-3
    • BB 0242292
    • 108-26-9
    • EN300-16236
    • 3-methyl-4,5-dihydro-1H-pyrazol-5-one
    • M0491
    • W-108724
    • UNII-P378M0497D
    • SY010796
    • 5-Methyl-2,4-dihydro-3H-pyrazol-3-one #
    • 3-Methyl-pyrazolon-(5) [German]
    • 2-PYRAZOLIN-5-ONE, 3-METHYL-
    • BRN 0606503
    • Z50145989
    • MFCD00020699
    • STL137537
    • DB-027098
    • P378M0497D
    • DTXCID6030106
    • NSC-4120
    • MDL: MFCD00020699
    • Inchi: 1S/C4H6N2O/c1-3-2-4(7)6-5-3/h2H2,1H3,(H,6,7)
    • InChI Key: NHLAPJMCARJFOG-UHFFFAOYSA-N
    • SMILES: O=C1CC(C)=NN1

Computed Properties

  • Exact Mass: 98.04800
  • Monoisotopic Mass: 98.048
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 7
  • Rotatable Bond Count: 0
  • Complexity: 128
  • 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
  • Surface Charge: 0
  • Tautomer Count: 5
  • XLogP3: -0.5
  • Topological Polar Surface Area: 41.5A^2

Experimental Properties

  • Color/Form: Not determined
  • Density: 1.1890 (rough estimate)
  • Melting Point: 220.0 to 224.0 deg-C
  • Boiling Point: 183.6°C (rough estimate)
  • Flash Point: 141.1℃
  • Refractive Index: 1.4327 (estimate)
  • Solubility: Slightly soluble in ethanol.
  • PSA: 41.46000
  • LogP: -0.35340
  • Solubility: Not determined

3-Methyl-1H-pyrazol-5(4H)-one Security Information

3-Methyl-1H-pyrazol-5(4H)-one Customs Data

  • HS CODE:2933199090
  • Customs Data:

    China Customs Code:

    2933199090

    Overview:

    2933199090. Other structurally non fused pyrazole ring compounds. 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:

    2933199090. other compounds containing an unfused pyrazole ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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3-Methyl-1H-pyrazol-5(4H)-one Production Method

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