Cas no 131358-04-8 (1,2-Diethoxy-4-ethylbenzene)

1,2-Diethoxy-4-ethylbenzene structure
1,2-Diethoxy-4-ethylbenzene structure
Product Name:1,2-Diethoxy-4-ethylbenzene
CAS No:131358-04-8
MF:C12H18O2
MW:194.270123958588
CID:6642367
PubChem ID:528827
Update Time:2024-01-29

1,2-Diethoxy-4-ethylbenzene Chemical and Physical Properties

Names and Identifiers

    • 131358-04-8
    • 1,2-Diethoxy-4-ethyl benzene
    • 1,2-Diethoxy-4-ethylbenzene
    • SCHEMBL2521728
    • UBLKIWURCMXRBT-UHFFFAOYSA-N
    • Benzene, 1,2-diethoxy-4-ethyl
    • Inchi: 1S/C12H18O2/c1-4-10-7-8-11(13-5-2)12(9-10)14-6-3/h7-9H,4-6H2,1-3H3
    • InChI Key: UBLKIWURCMXRBT-UHFFFAOYSA-N
    • SMILES: O(CC)C1=C(C=CC(=C1)CC)OCC

Computed Properties

  • Exact Mass: 194.130679813g/mol
  • 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: 147
  • 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: 18.5?2
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