Cas no 650601-28-8 (Benzaldehyde, 3,3'-(1,2-ethanediyl)bis[2-hydroxy-)

Benzaldehyde, 3,3'-(1,2-ethanediyl)bis[2-hydroxy- structure
650601-28-8 structure
Product Name:Benzaldehyde, 3,3'-(1,2-ethanediyl)bis[2-hydroxy-
CAS No:650601-28-8
MF:C16H14O4
MW:270.279964923859
CID:408963
PubChem ID:11818080
Update Time:2025-04-19

Benzaldehyde, 3,3'-(1,2-ethanediyl)bis[2-hydroxy- Chemical and Physical Properties

Names and Identifiers

    • 3-[2-(3-formyl-2-hydroxyphenyl)ethyl]-2-hydroxybenzaldehyde
    • 3,3'-(Ethane-1,2-diyl)bis(2-hydroxybenzaldehyde)
    • 650601-28-8
    • SCHEMBL21002293
    • DTXSID00473634
    • Benzaldehyde, 3,3'-(1,2-ethanediyl)bis[2-hydroxy-
    • Inchi: 1S/C16H14O4/c17-9-13-5-1-3-11(15(13)19)7-8-12-4-2-6-14(10-18)16(12)20/h1-6,9-10,19-20H,7-8H2
    • InChI Key: NSDCPBGEJLYNBW-UHFFFAOYSA-N
    • SMILES: OC1C(C=O)=CC=CC=1CCC1C=CC=C(C=O)C=1O

Computed Properties

  • Exact Mass: 270.08922
  • Monoisotopic Mass: 270.08920892g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 5
  • Complexity: 298
  • 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: 3.5
  • Topological Polar Surface Area: 74.6?2

Experimental Properties

  • PSA: 74.6
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