Cas no 81885-74-7 (4-(2,5-Dimethoxyphenyl)butan-2-one)

4-(2,5-Dimethoxyphenyl)butan-2-one structure
81885-74-7 structure
Product Name:4-(2,5-Dimethoxyphenyl)butan-2-one
CAS No:81885-74-7
MF:C12H16O3
MW:208.253643989563
CID:1029001
PubChem ID:11009134
Update Time:2025-04-20

4-(2,5-Dimethoxyphenyl)butan-2-one Chemical and Physical Properties

Names and Identifiers

    • 4-(2,5-Dimethoxyphenyl)butan-2-one
    • 4-(2,5-dimethoxyphenyl)-2-Butanone
    • 81885-74-7
    • DTXSID40451719
    • FT-0739119
    • SCHEMBL11077966
    • AKOS013847219
    • EN300-1845386
    • CS-0275929
    • DB-075795
    • Inchi: 1S/C12H16O3/c1-9(13)4-5-10-8-11(14-2)6-7-12(10)15-3/h6-8H,4-5H2,1-3H3
    • InChI Key: VSHJVOQBBGHZMW-UHFFFAOYSA-N
    • SMILES: O(C)C1C=CC(=CC=1CCC(C)=O)OC

Computed Properties

  • Exact Mass: 208.109944368g/mol
  • Monoisotopic Mass: 208.109944368g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 5
  • Complexity: 203
  • 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: 1.9
  • Topological Polar Surface Area: 35.5?2

4-(2,5-Dimethoxyphenyl)butan-2-one Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
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81885-74-7 95%
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Enamine
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$1778.0 2023-09-19
Chemenu
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Enamine
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Enamine
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