Cas no 61552-32-7 (Benzaldehyde, 2-methoxy-4-methyl-5-(phenylmethoxy)-)

Benzaldehyde, 2-methoxy-4-methyl-5-(phenylmethoxy)- structure
61552-32-7 structure
Product Name:Benzaldehyde, 2-methoxy-4-methyl-5-(phenylmethoxy)-
CAS No:61552-32-7
MF:C16H16O3
MW:256.296444892883
CID:475137
PubChem ID:71394668
Update Time:2025-04-19

Benzaldehyde, 2-methoxy-4-methyl-5-(phenylmethoxy)- Chemical and Physical Properties

Names and Identifiers

    • Benzaldehyde, 2-methoxy-4-methyl-5-(phenylmethoxy)-
    • 2-methoxy-4-methyl-5-phenylmethoxybenzaldehyde
    • 5-(Benzyloxy)-2-methoxy-4-methylbenzaldehyde
    • DTXSID40816344
    • 61552-32-7
    • Inchi: 1S/C16H16O3/c1-12-8-16(18-2)14(10-17)9-15(12)19-11-13-6-4-3-5-7-13/h3-10H,11H2,1-2H3
    • InChI Key: YPMMHSOHOBFFCE-UHFFFAOYSA-N
    • SMILES: O(CC1C=CC=CC=1)C1C=C(C=O)C(=CC=1C)OC

Computed Properties

  • Exact Mass: 256.10998
  • Monoisotopic Mass: 256.109944368g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 5
  • Complexity: 273
  • 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: 3.2
  • Topological Polar Surface Area: 35.5?2

Experimental Properties

  • PSA: 35.53
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