Cas no 2096334-18-6 (1-(Cyclopropylmethyl)-1H-pyrazole-5-boronic acid, dihydrate)

1-(Cyclopropylmethyl)-1H-pyrazole-5-boronic acid, dihydrate structure
2096334-18-6 structure
Product Name:1-(Cyclopropylmethyl)-1H-pyrazole-5-boronic acid, dihydrate
CAS No:2096334-18-6
MF:C7H15BN2O4
MW:202.016001939774
MDL:MFCD22205765
CID:4637973
Update Time:2023-08-10

1-(Cyclopropylmethyl)-1H-pyrazole-5-boronic acid, dihydrate Chemical and Physical Properties

Names and Identifiers

    • 1-(Cyclopropylmethyl)-1H-pyrazole-5-boronic acid, dihydrate
    • C7H11BN2O2.2H2O
    • W2851
    • [2-(cyclopropylmethyl)pyrazol-3-yl]boronic acid;dihydrate
    • 1-(Cyclopropylmethyl)-1H-pyrazole-5-boronic acid dihydrate
    • (1-(Cyclopropylmethyl)-1H-pyrazol-5-yl)boronic acid dihydrate
    • MDL: MFCD22205765
    • Inchi: 1S/C7H11BN2O2.2H2O/c11-8(12)7-3-4-9-10(7)5-6-1-2-6;;/h3-4,6,11-12H,1-2,5H2;2*1H2
    • InChI Key: JYFMKTBMMXKIEE-UHFFFAOYSA-N
    • SMILES: OB(C1=CC=NN1CC1CC1)O.O.O

Computed Properties

  • Hydrogen Bond Donor Count: 4
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 3
  • Complexity: 164
  • Topological Polar Surface Area: 60.3

1-(Cyclopropylmethyl)-1H-pyrazole-5-boronic acid, dihydrate Pricemore >>

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