Cas no 820236-89-3 (Benzaldehyde, 2,3-dimethyl-4-propoxy-)

Benzaldehyde, 2,3-dimethyl-4-propoxy- structure
820236-89-3 structure
Product Name:Benzaldehyde, 2,3-dimethyl-4-propoxy-
CAS No:820236-89-3
MF:C12H16O2
MW:192.254243850708
CID:700664
PubChem ID:11679967
Update Time:2025-04-19

Benzaldehyde, 2,3-dimethyl-4-propoxy- Chemical and Physical Properties

Names and Identifiers

    • Benzaldehyde, 2,3-dimethyl-4-propoxy-
    • 2,3-dimethyl-4-propoxybenzaldehyde
    • DTXSID80470489
    • SCHEMBL5456528
    • 820236-89-3
    • HCKJSSLOZNVRGA-UHFFFAOYSA-N
    • Inchi: 1S/C12H16O2/c1-4-7-14-12-6-5-11(8-13)9(2)10(12)3/h5-6,8H,4,7H2,1-3H3
    • InChI Key: HCKJSSLOZNVRGA-UHFFFAOYSA-N
    • SMILES: O(CCC)C1=CC=C(C=O)C(C)=C1C

Computed Properties

  • Exact Mass: 192.115029749g/mol
  • Monoisotopic Mass: 192.115029749g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 4
  • Complexity: 179
  • 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
  • Topological Polar Surface Area: 26.3?2
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