Cas no 1004643-52-0 ((4-Chloro-3,5-dimethyl-1H-pyrazol-1-yl)-acetonitrile)

(4-Chloro-3,5-dimethyl-1H-pyrazol-1-yl)-acetonitrile structure
1004643-52-0 structure
Product Name:(4-Chloro-3,5-dimethyl-1H-pyrazol-1-yl)-acetonitrile
CAS No:1004643-52-0
MF:C7H8ClN3
MW:169.611519813538
CID:1070832
PubChem ID:7017733
Update Time:2025-09-24

(4-Chloro-3,5-dimethyl-1H-pyrazol-1-yl)-acetonitrile Chemical and Physical Properties

Names and Identifiers

    • (4-Chloro-3,5-dimethyl-1H-pyrazol-1-yl)-acetonitrile
    • AKOS B020926
    • ART-CHEM-BB B020926
    • (4-CHLORO-3,5-DIMETHYL-PYRAZOL-1-YL)-ACETONITRILE
    • (4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)acetonitrile
    • STK312134
    • ALBB-004620
    • AKOS000310663
    • DB-016493
    • CS-0329937
    • DTXSID201239701
    • 1004643-52-0
    • (4-CHLORO-3,5-DIMETHYL-1H-PYRAZOL-1-YL)METHYL CYANIDE
    • (4-chloro-3,5-dimethylpyrazol-1-yl)acetonitrile
    • 4-Chloro-3,5-dimethyl-1H-pyrazole-1-acetonitrile
    • 2-(4-chloro-3,5-dimethylpyrazol-1-yl)acetonitrile
    • 2-(4-Chloro-3,5-dimethyl-1H-pyrazol-1-yl)acetonitrile
    • MDL: MFCD04970011
    • Inchi: 1S/C7H8ClN3/c1-5-7(8)6(2)11(10-5)4-3-9/h4H2,1-2H3
    • InChI Key: OLOYPLHXOYMVOF-UHFFFAOYSA-N
    • SMILES: ClC1C(C)=NN(CC#N)C=1C

Computed Properties

  • Exact Mass: 169.0406750g/mol
  • Monoisotopic Mass: 169.0406750g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 1
  • Complexity: 185
  • 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: 1.5
  • Topological Polar Surface Area: 41.6?2

(4-Chloro-3,5-dimethyl-1H-pyrazol-1-yl)-acetonitrile Security Information

  • HazardClass:IRRITANT

(4-Chloro-3,5-dimethyl-1H-pyrazol-1-yl)-acetonitrile Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
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(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)acetonitrile
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