Cas no 1006473-31-9 (4-chloro-1-(1H-pyrazol-1-yl)methyl-1H-pyrazole-3-carboxylic acid)

4-chloro-1-(1H-pyrazol-1-yl)methyl-1H-pyrazole-3-carboxylic acid structure
1006473-31-9 structure
Product Name:4-chloro-1-(1H-pyrazol-1-yl)methyl-1H-pyrazole-3-carboxylic acid
CAS No:1006473-31-9
MF:C8H7ClN4O2
MW:226.619779825211
MDL:MFCD04967772
CID:3058382
PubChem ID:19618549
Update Time:2025-04-21

4-chloro-1-(1H-pyrazol-1-yl)methyl-1H-pyrazole-3-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 1-((1H-Pyrazol-1-yl)methyl)-4-chloro-1H-pyrazole-3-carboxylic acid
    • 4-Chloro-1-(1H-pyrazol-1-ylmethyl)-1H-pyrazole-3-carboxylic acid
    • 4-chloro-1-(1H-pyrazol-1-yl)methyl-1H-pyrazole-3-carboxylic acid
    • BBL039800
    • 4-chloro-1-[(1H-pyrazol-1-yl)methyl]-1H-pyrazole-3-carboxylic acid
    • STK349354
    • 4-chloro-1-(pyrazol-1-ylmethyl)pyrazole-3-carboxylic acid
    • 1006473-31-9
    • CS-0264409
    • 1-((1H-Pyrazol-1-yl)methyl)-4-chloro-1H-pyrazole-3-carboxylicacid
    • AKOS000306600
    • GQB47331
    • MFCD04967772
    • EN300-92730
    • MDL： MFCD04967772
    • Inchi： 1S/C8H7ClN4O2/c9-6-4-13(11-7(6)8(14)15)5-12-3-1-2-10-12/h1-4H,5H2,(H,14,15)
    • InChI Key： VVYFVYPPRVLBSG-UHFFFAOYSA-N
    • SMILES： ClC1C(C(=O)O)=NN(C=1)CN1C=CC=N1

Computed Properties

  • Exact Mass: 226.0257532Da
  • Monoisotopic Mass: 226.0257532Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 3
  • Complexity: 253
  • 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: 0.9
  • Topological Polar Surface Area: 72.9?2

4-chloro-1-(1H-pyrazol-1-yl)methyl-1H-pyrazole-3-carboxylic acid Pricemore >>

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AB498890-1 g
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AB498890-5 g
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