Cas no 835-24-5 (1-(2,4,6-trimethoxyphenyl)propan-2-ol)

1-(2,4,6-trimethoxyphenyl)propan-2-ol structure
835-24-5 structure
Product Name:1-(2,4,6-trimethoxyphenyl)propan-2-ol
CAS No:835-24-5
MF:C12H18O4
MW:226.268924236298
CID:5751106
PubChem ID:46193332
Update Time:2024-03-01

1-(2,4,6-trimethoxyphenyl)propan-2-ol Chemical and Physical Properties

Names and Identifiers

    • Benzeneethanol, 2,4,6-trimethoxy-α-methyl-
    • 1-(2,4,6-trimethoxyphenyl)propan-2-ol
    • SCHEMBL17831935
    • 835-24-5
    • EN300-1813789
    • Inchi: 1S/C12H18O4/c1-8(13)5-10-11(15-3)6-9(14-2)7-12(10)16-4/h6-8,13H,5H2,1-4H3
    • InChI Key: QOMRDZJCJCSSLB-UHFFFAOYSA-N
    • SMILES: C1(CC(C)O)=C(OC)C=C(OC)C=C1OC

Computed Properties

  • Exact Mass: 226.12050905g/mol
  • Monoisotopic Mass: 226.12050905g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 5
  • Complexity: 184
  • 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
  • XLogP3: 1.8
  • Topological Polar Surface Area: 47.9?2

Experimental Properties

  • Density: 1.084±0.06 g/cm3(Predicted)
  • Melting Point: 74-75 °C
  • Boiling Point: 342.1±37.0 °C(Predicted)
  • pka: 14.76±0.20(Predicted)

1-(2,4,6-trimethoxyphenyl)propan-2-ol Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Enamine
EN300-1813789-0.05g
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Enamine
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Enamine
EN300-1813789-10.0g
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