Cas no 36140-83-7 (3-(3,5-dimethylpyrazol-1-yl)-3-oxo-propanenitrile)

3-(3,5-dimethylpyrazol-1-yl)-3-oxo-propanenitrile structure
36140-83-7 structure
Product Name:3-(3,5-dimethylpyrazol-1-yl)-3-oxo-propanenitrile
CAS No:36140-83-7
MF:C8H9N3O
MW:163.176561117172
MDL:MFCD00051954
CID:89184
PubChem ID:262101
Update Time:2025-04-18

3-(3,5-dimethylpyrazol-1-yl)-3-oxo-propanenitrile Chemical and Physical Properties

Names and Identifiers

    • 1-Cyanoacetyl-3,5-dimethylpyrazole
    • 3-(3,5-Dimethyl-1H-pyrazol-1-yl)-3-oxopropanenitrile
    • 3-(3,5-dimethylpyrazol-1-yl)-3-oxopropanenitrile
    • 1-(cyanoacetyl)-3,5-dimethyl-1H-pyrazole
    • 1-cyanoacetyl-3,4-dimethylpyrazole
    • 1-cyanoacetyl-3,5-dimethyl-pyrazole
    • 1h-pyrazole-1-propanenitrile,3,5-dimethyl-
    • 3-(3,5-dimethyl-1H-pyrazol-1-yl)-3-oxopropanonitrile
    • 3-(3,5-dimethyl-pyrazol-1-yl)-3-oxopropionitrile
    • 3-(3,5-dimethylpyrazolyl)-3-oxopropanenitrile
    • A-oxo
    • 3-(3,5-dimethylpyrazol-1-yl)-3-oxo-propanenitrile
    • NSC95424
    • MFCD00051954
    • NSC-95424
    • FT-0607662
    • 1-Cyanoacetyl-3,5-dimethyl-1H-pyrazole,97%
    • 36140-83-7
    • AKOS000271097
    • CS-0111031
    • HMS1578N01
    • SY167690
    • Z57965524
    • 1-Cyanoacetyl-3,5-dimethyl-1H-pyrazole
    • SCHEMBL1950063
    • Cambridge id 5140887
    • 1,Cyanoacetyl-3,5-dimethylpyrazole
    • DTXSID90294239
    • EN300-26906
    • 3-(3,5-Dimethyl-1H-pyrazol-1-yl)-3-oxopropanenitrile #
    • 3-(3,5-Dimethyl-1-pyrazolyl)-3-oxopropanenitrile
    • 1H-pyrazole-1-propanenitrile, 3,5-dimethyl-beta-oxo-
    • DB-423829
    • ALBB-027946
    • MDL： MFCD00051954
    • Inchi： 1S/C8H9N3O/c1-6-5-7(2)11(10-6)8(12)3-4-9/h5H,3H2,1-2H3
    • InChI Key： DDWZYWSLHBDVGR-UHFFFAOYSA-N
    • SMILES： O=C(CC#N)N1C(C)=CC(C)=N1
    • BRN： 6286

Computed Properties

  • Exact Mass: 163.07500
  • Monoisotopic Mass: 163.075
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 230
  • 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: nothing
  • XLogP3: 0.8
  • Topological Polar Surface Area: 58.7A^2

Experimental Properties

  • Color/Form: Yellow to Brown Solid
  • Density: 1.16
  • Melting Point: 118-122 °C
  • Boiling Point: 331.4°Cat760mmHg
  • Flash Point: 154.2°C
  • Refractive Index: 1.572
  • PSA: 58.68000
  • LogP: 1.05378
  • Sensitiveness: Hygroscopic
  • Solubility: Not determined

3-(3,5-dimethylpyrazol-1-yl)-3-oxo-propanenitrile Security Information

3-(3,5-dimethylpyrazol-1-yl)-3-oxo-propanenitrile 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%

3-(3,5-dimethylpyrazol-1-yl)-3-oxo-propanenitrile Pricemore >>

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3-(3,5-dimethylpyrazol-1-yl)-3-oxo-propanenitrile Suppliers

Amadis Chemical Company Limited
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(CAS:36140-83-7)3-(3,5-dimethylpyrazol-1-yl)-3-oxo-propanenitrile
Order Number:A853649
Stock Status:in Stock
Quantity:100g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 07:46
Price ($):212.0

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Amadis Chemical Company Limited
(CAS:36140-83-7)3-(3,5-dimethylpyrazol-1-yl)-3-oxo-propanenitrile
A853649
Purity:99%
Quantity:100g
Price ($):212.0
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