Cas no 568596-61-2 (Phenol, 3-methyl-4-[4-[1-(triphenylmethyl)-1H-pyrazol-4-yl]butyl]-)

Phenol, 3-methyl-4-[4-[1-(triphenylmethyl)-1H-pyrazol-4-yl]butyl]- structure
568596-61-2 structure
Product Name:Phenol, 3-methyl-4-[4-[1-(triphenylmethyl)-1H-pyrazol-4-yl]butyl]-
CAS No:568596-61-2
MF:C33H32N2O
MW:472.619988441467
CID:1600236
Update Time:2024-08-30

Phenol, 3-methyl-4-[4-[1-(triphenylmethyl)-1H-pyrazol-4-yl]butyl]- Chemical and Physical Properties

Names and Identifiers

    • Phenol, 3-methyl-4-[4-[1-(triphenylmethyl)-1H-pyrazol-4-yl]butyl]-
    • Inchi: 1S/C33H32N2O/c1-26-23-32(36)22-21-28(26)14-12-11-13-27-24-34-35(25-27)33(29-15-5-2-6-16-29,30-17-7-3-8-18-30)31-19-9-4-10-20-31/h2-10,15-25,36H,11-14H2,1H3
    • InChI Key: WTZWQBKINFQSOE-UHFFFAOYSA-N
    • SMILES: C1(O)=CC=C(CCCCC2=CN(C(C3=CC=CC=C3)(C3=CC=CC=C3)C3=CC=CC=C3)N=C2)C(C)=C1

Computed Properties

  • Exact Mass: 472.25166

Experimental Properties

  • Density: 1.07±0.1 g/cm3(Predicted)
  • Boiling Point: 663.7±55.0 °C(Predicted)
  • PSA: 38.05
  • pka: 10.28±0.20(Predicted)
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