Cas no 1006455-70-4 (3-(3-amino-4-chloro-1H-pyrazol-1-yl)propanoic acid)

3-(3-amino-4-chloro-1H-pyrazol-1-yl)propanoic acid structure
1006455-70-4 structure
Product Name:3-(3-amino-4-chloro-1H-pyrazol-1-yl)propanoic acid
CAS No:1006455-70-4
MF:C6H8ClN3O2
MW:189.599619865417
MDL:MFCD04969590
CID:3160075
PubChem ID:19620618
Update Time:2025-09-25

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

Names and Identifiers

    • 3-(3-amino-4-chloro-1H-pyrazol-1-yl)propanoic acid
    • AKOS000309924
    • 1006455-70-4
    • EN300-229449
    • BBL040959
    • 3-(3-amino-4-chloropyrazol-1-yl)propanoic acid
    • 3-(3-AMINO-4-CHLORO-1H-PYRAZOL-1-YL)PROPANOICACID
    • CS-0240641
    • GQB45570
    • STL414457
    • MDL: MFCD04969590
    • Inchi: 1S/C6H8ClN3O2/c7-4-3-10(9-6(4)8)2-1-5(11)12/h3H,1-2H2,(H2,8,9)(H,11,12)
    • InChI Key: QWBCQBAMCWCPMP-UHFFFAOYSA-N
    • SMILES: ClC1C(N)=NN(C=1)CCC(=O)O

Computed Properties

  • Exact Mass: 189.0305042Da
  • Monoisotopic Mass: 189.0305042Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 3
  • Complexity: 178
  • 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: -0.1
  • Topological Polar Surface Area: 81.1?2

3-(3-amino-4-chloro-1H-pyrazol-1-yl)propanoic acid Pricemore >>

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