Cas no 81674-79-5 (Guaimesal)

Guaimesal structure
Guaimesal structure
Product Name:Guaimesal
CAS No:81674-79-5
MF:C16H14O5
MW:286.279365062714
CID:60357
PubChem ID:71250
Update Time:2025-04-18

Guaimesal Chemical and Physical Properties

Names and Identifiers

    • Guaimesal
    • 2-(2-Methoxyphenoxy)-2-methyl-4H-1,3-benzodioxin-4-one
    • 2-(2-methoxyphenoxy)-2-methyl-1,3-benzodioxin-4-one
    • Guaimesalum
    • MR 693
    • Q15633270
    • CHEBI:135184
    • GUAIMESAL [WHO-DD]
    • UNII-K43273G1CW
    • 81674-79-5
    • SCHEMBL1650041
    • 2-(o-Methoxyphenoxy)-2-methyl-1,3-benzodioxan-4-one
    • 4H-1,3-Benzodioxin-4-one,2-(2-methoxyphenoxy)-2-methyl-
    • Guaimesalum [Latin]
    • (+/-)-2-(O-METHOXYPHENOXY)-2-METHYL-1,3-BENZODIOXAN-4-ONE
    • Guaimesal [INN]
    • DTXSID00868622
    • CHEMBL2105115
    • (+-)-2-(o-Methoxyphenoxy)-2-methyl-1,3-benzodioxan-4-one
    • NS00124494
    • 2-(2-methoxyphenoxy)-2-methyl-1,3-benzodioxan-4-one
    • GUAIMESAL [MART.]
    • K43273G1CW
    • Inchi: 1S/C16H14O5/c1-16(20-14-10-6-5-9-13(14)18-2)19-12-8-4-3-7-11(12)15(17)21-16/h3-10H,1-2H3
    • InChI Key: PSVDIHULUCLEJE-UHFFFAOYSA-N
    • SMILES: O1C2C=CC=CC=2C(=O)OC1(C)OC1C=CC=CC=1OC

Computed Properties

  • Exact Mass: 286.08400
  • Monoisotopic Mass: 286.084
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 3
  • Complexity: 385
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 54A^2
  • XLogP3: 3.6

Experimental Properties

  • Density: 1.262
  • Boiling Point: 454.7 °C at 760 mmHg
  • Flash Point: 454.7 °C at 760 mmHg
  • Refractive Index: 1.573
  • PSA: 53.99000
  • LogP: 2.99710

Guaimesal Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
G811000-25mg
Guaimesal
81674-79-5
25mg
$81.00 2023-05-18
TRC
G811000-50mg
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50mg
$144.00 2023-05-18
TRC
G811000-100mg
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$270.00 2023-05-18
TRC
G811000-250mg
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250mg
$592.00 2023-05-18
TRC
G811000-500mg
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500mg
$ 800.00 2023-09-07
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