Cas no 890597-34-9 (3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)propanoic acid)

3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)propanoic acid structure
890597-34-9 structure
Product Name:3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)propanoic acid
CAS No:890597-34-9
MF:C8H11ClN2O2
MW:202.638140916824
MDL:MFCD03419665
CID:1078270
PubChem ID:3159600
Update Time:2025-04-20

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

Names and Identifiers

    • 3-(4-Chloro-3,5-dimethyl-pyrazol-1-yl)-propionic acid
    • F1986-0003
    • VS-09546
    • 3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)propanoic acid
    • EN300-83584
    • DTXSID10390186
    • AKOS000270496
    • BB 0219229
    • MFCD03419665
    • 3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)propanoicacid
    • 3-(4-Chloro-3,5-dimethyl-pyrazol-1-yl)propanoic acid
    • 890597-34-9
    • 3-(4-chloro-3,5-dimethylpyrazol-1-yl)propanoic acid
    • VU0494614-1
    • G21683
    • ALBB-004413
    • BBL029987
    • STK298907
    • MDL: MFCD03419665
    • Inchi: 1S/C8H11ClN2O2/c1-5-8(9)6(2)11(10-5)4-3-7(12)13/h3-4H2,1-2H3,(H,12,13)
    • InChI Key: DAMXGMGAXXOOTI-UHFFFAOYSA-N
    • SMILES: ClC1C(C)=NN(C=1C)CCC(=O)O

Computed Properties

  • Exact Mass: 202.0509053g/mol
  • Monoisotopic Mass: 202.0509053g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 3
  • Complexity: 201
  • 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: 1.1
  • Topological Polar Surface Area: 55.1?2

3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)propanoic acid Security Information

  • Hazardous Material Identification: Xi
  • HazardClass:IRRITANT

3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)propanoic acid Pricemore >>

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Ambeed
A119455-1g
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abcr
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