Cas no 56074-73-8 (Benzaldehyde, 2-[(3-methyl-2-butenyl)oxy]-)

Benzaldehyde, 2-[(3-methyl-2-butenyl)oxy]- structure
56074-73-8 structure
Product Name:Benzaldehyde, 2-[(3-methyl-2-butenyl)oxy]-
CAS No:56074-73-8
MF:C12H14O2
MW:190.238363742828
CID:349904
PubChem ID:10702842
Update Time:2025-04-19

Benzaldehyde, 2-[(3-methyl-2-butenyl)oxy]- Chemical and Physical Properties

Names and Identifiers

    • Benzaldehyde, 2-[(3-methyl-2-butenyl)oxy]-
    • 2-(3-methylbut-2-enoxy)benzaldehyde
    • QMYNUASZONCCEI-UHFFFAOYSA-N
    • AKOS000249122
    • DTXSID60443696
    • 56074-73-8
    • SCHEMBL4241452
    • 2-(3-methyl-2-butenyloxy)-benzaldehyde
    • Inchi: 1S/C12H14O2/c1-10(2)7-8-14-12-6-4-3-5-11(12)9-13/h3-7,9H,8H2,1-2H3
    • InChI Key: QMYNUASZONCCEI-UHFFFAOYSA-N
    • SMILES: O(C1C=CC=CC=1C=O)C/C=C(\C)/C

Computed Properties

  • Exact Mass: 190.09942
  • Monoisotopic Mass: 190.099379685g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 4
  • Complexity: 204
  • 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: 26.3?2

Experimental Properties

  • PSA: 26.3
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