Cas no 252026-23-6 (Methanone, [5-(4-hydroxyphenyl)-2,3-pyrazinediyl]bis[(4-hydroxyphenyl)-)

Methanone, [5-(4-hydroxyphenyl)-2,3-pyrazinediyl]bis[(4-hydroxyphenyl)- structure
252026-23-6 structure
Product Name:Methanone, [5-(4-hydroxyphenyl)-2,3-pyrazinediyl]bis[(4-hydroxyphenyl)-
CAS No:252026-23-6
MF:C24H16N2O5
MW:412.394246101379
CID:1421667
Update Time:2024-08-15

Methanone, [5-(4-hydroxyphenyl)-2,3-pyrazinediyl]bis[(4-hydroxyphenyl)- Chemical and Physical Properties

Names and Identifiers

    • Methanone, [5-(4-hydroxyphenyl)-2,3-pyrazinediyl]bis[(4-hydroxyphenyl)-
    • Methanone, 1,1'-[5-(4-hydroxyphenyl)-2,3-pyrazinediyl]bis[1-(4-hydroxyphenyl)-
    • Inchi: 1S/C24H16N2O5/c27-17-7-1-14(2-8-17)20-13-25-21(23(30)15-3-9-18(28)10-4-15)22(26-20)24(31)16-5-11-19(29)12-6-16/h1-13,27-29H
    • InChI Key: AVYFCSACADRIED-UHFFFAOYSA-N
    • SMILES: OC1C=CC(C(C2C(C(C3C=CC(O)=CC=3)=O)=NC(C3C=CC(O)=CC=3)=CN=2)=O)=CC=1

Computed Properties

  • Exact Mass: 412.10598
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 7
  • Heavy Atom Count: 31
  • XLogP3: 0.609

Experimental Properties

  • Density: 1.408±0.06 g/cm3(Predicted)
  • Melting Point: 144 °C
  • Boiling Point: 760.4±60.0 °C(Predicted)
  • PSA: 120.61
  • pka: 6.14±0.15(Predicted)
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