Cas no 2403-59-0 (Benzene,1-(diethoxymethyl)-4-methyl-)

Benzene,1-(diethoxymethyl)-4-methyl- structure
2403-59-0 structure
Product Name:Benzene,1-(diethoxymethyl)-4-methyl-
CAS No:2403-59-0
MF:C12H18O2
MW:194.270123958588
CID:280772
PubChem ID:75469
Update Time:2025-04-19

Benzene,1-(diethoxymethyl)-4-methyl- Chemical and Physical Properties

Names and Identifiers

    • Benzene,1-(diethoxymethyl)-4-methyl-
    • 1-(diethoxymethyl)-4-methylbenzene
    • p-(Diethoxymethyl)toluene
    • NS00027543
    • ZPU3NY92Q7
    • AKOS006318071
    • NSC296503
    • 2403-59-0
    • NSC-296503
    • SCHEMBL3906858
    • DTXSID80178776
    • 4-Methylbenzaldehyde diethyl acetal
    • 1-Diethoxymethyl-4-methylbenzene
    • NSC 296503
    • Benzene, 1-(diethoxymethyl)-4-methyl-
    • EINECS 219-289-1
    • Inchi: 1S/C12H18O2/c1-4-13-12(14-5-2)11-8-6-10(3)7-9-11/h6-9,12H,4-5H2,1-3H3
    • InChI Key: KCKGLVOPXDIEIJ-UHFFFAOYSA-N
    • SMILES: O(CC)C(C1C=CC(C)=CC=1)OCC

Computed Properties

  • Exact Mass: 194.13074
  • Monoisotopic Mass: 194.130679813g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 5
  • Complexity: 133
  • 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: 2.7
  • Topological Polar Surface Area: 18.5?2

Experimental Properties

  • PSA: 18.46

Benzene,1-(diethoxymethyl)-4-methyl- Related Literature

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