Cas no 897950-01-5 (Benzaldehyde, 3-methoxy-5-(3-methoxypropoxy)-)

Benzaldehyde, 3-methoxy-5-(3-methoxypropoxy)- structure
897950-01-5 structure
Product Name:Benzaldehyde, 3-methoxy-5-(3-methoxypropoxy)-
CAS No:897950-01-5
MF:C12H16O4
MW:224.253044128418
CID:588965
PubChem ID:59817759
Update Time:2025-04-19

Benzaldehyde, 3-methoxy-5-(3-methoxypropoxy)- Chemical and Physical Properties

Names and Identifiers

    • Benzaldehyde, 3-methoxy-5-(3-methoxypropoxy)-
    • 3-methoxy-5-(3-methoxypropoxy)benzaldehyde
    • 3-Methoxy-5-(3-methoxy-propoxy)-benzaldehyde
    • SCHEMBL89112
    • YHXVYCQKFBTFLI-UHFFFAOYSA-N
    • DTXSID10733074
    • 897950-01-5
    • Inchi: 1S/C12H16O4/c1-14-4-3-5-16-12-7-10(9-13)6-11(8-12)15-2/h6-9H,3-5H2,1-2H3
    • InChI Key: YHXVYCQKFBTFLI-UHFFFAOYSA-N
    • SMILES: O(C1C=C(C=C(C=O)C=1)OC)CCCOC

Computed Properties

  • Exact Mass: 224.10485899g/mol
  • Monoisotopic Mass: 224.10485899g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 7
  • Complexity: 196
  • 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: 1.5
  • Topological Polar Surface Area: 44.8?2
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