Cas no 956354-96-4 (3-(4-Chloro-3,5-dimethyl-1H-pyrazol-1-yl)butanoic acid)

3-(4-Chloro-3,5-dimethyl-1H-pyrazol-1-yl)butanoic acid structure
956354-96-4 structure
Product Name:3-(4-Chloro-3,5-dimethyl-1H-pyrazol-1-yl)butanoic acid
CAS No:956354-96-4
MF:C9H13ClN2O2
MW:216.664721250534
MDL:MFCD05668685
CID:3056956
PubChem ID:3159308
Update Time:2025-04-21

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

Names and Identifiers

    • 3-(4-Chloro-3,5-dimethyl-1H-pyrazol-1-yl)butanoic acid
    • 3-(4-chloro-3,5-dimethyl-pyrazol-1-yl)-butyric acid, AldrichCPR
    • EN300-237804
    • AKOS000270504
    • 3-(4-chloro-3,5-dimethyl-pyrazol-1-yl)butanoic acid
    • BRD-A81727166-001-01-5
    • 3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)butanoicacid
    • STL232070
    • 3-(4-Chloro-3,5-dimethyl-pyrazol-1-yl)-butyric acid
    • F1986-0004
    • 956354-96-4
    • BAS 09914763
    • SB75115
    • 3-(4-chloro-3,5-dimethylpyrazol-1-yl)butanoic acid
    • AT45142
    • GNB35496
    • MDL: MFCD05668685
    • Inchi: 1S/C9H13ClN2O2/c1-5(4-8(13)14)12-7(3)9(10)6(2)11-12/h5H,4H2,1-3H3,(H,13,14)
    • InChI Key: FRWXGXNZFHQBNL-UHFFFAOYSA-N
    • SMILES: ClC1C(C)=NN(C=1C)C(C)CC(=O)O

Computed Properties

  • Exact Mass: 216.0665554g/mol
  • Monoisotopic Mass: 216.0665554g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 3
  • Complexity: 225
  • 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: 1.5
  • Topological Polar Surface Area: 55.1?2

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

  • Hazard Category Code: 22
  • Hazardous Material Identification: Xn
  • HazardClass:IRRITANT

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

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Fluorochem
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Fluorochem
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Chemenu
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TRC
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