Cas no 1006333-97-6 (3-(4-Chloro-1H-pyrazol-1-yl)butanenitrile)

3-(4-Chloro-1H-pyrazol-1-yl)butanenitrile structure
1006333-97-6 structure
Product Name:3-(4-Chloro-1H-pyrazol-1-yl)butanenitrile
CAS No:1006333-97-6
MF:C7H8ClN3
MW:169.611519813538
MDL:MFCD08558148
CID:3056968
PubChem ID:19616524
Update Time:2025-04-21

3-(4-Chloro-1H-pyrazol-1-yl)butanenitrile Chemical and Physical Properties

Names and Identifiers

    • 3-(4-Chloro-1H-pyrazol-1-yl)butanenitrile
    • 1006333-97-6
    • CS-0275740
    • 4-Chloro-I(2)-methyl-1H-pyrazole-1-propanenitrile
    • GQB33397
    • DTXSID701249402
    • STK350862
    • 3-(4-chloropyrazol-1-yl)butanenitrile
    • AKOS000313426
    • EN300-230750
    • BBL040685
    • MDL： MFCD08558148
    • Inchi： 1S/C7H8ClN3/c1-6(2-3-9)11-5-7(8)4-10-11/h4-6H,2H2,1H3
    • InChI Key： LWFIZOLZYRWLSW-UHFFFAOYSA-N
    • SMILES： ClC1C=NN(C=1)C(C)CC#N

Computed Properties

  • Exact Mass: 169.0406750Da
  • Monoisotopic Mass: 169.0406750Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 2
  • Complexity: 174
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0.9
  • Topological Polar Surface Area: 41.6?2

3-(4-Chloro-1H-pyrazol-1-yl)butanenitrile Pricemore >>

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