Cas no 81226-96-2 ((2E)-3-(2-hydroxyphenyl)-1-(4-methylphenyl)prop-2-en-1-one)

(2E)-3-(2-hydroxyphenyl)-1-(4-methylphenyl)prop-2-en-1-one structure
81226-96-2 structure
Product Name:(2E)-3-(2-hydroxyphenyl)-1-(4-methylphenyl)prop-2-en-1-one
CAS No:81226-96-2
MF:C16H14O2
MW:238.281164646149
CID:986527
PubChem ID:5383463
Update Time:2025-04-20

(2E)-3-(2-hydroxyphenyl)-1-(4-methylphenyl)prop-2-en-1-one Chemical and Physical Properties

Names and Identifiers

    • (2E)-3-(2-hydroxyphenyl)-1-(4-methylphenyl)prop-2-en-1-one
    • (E)-3-(2-hydroxyphenyl)-1-(4-methylphenyl)prop-2-en-1-one
    • 3-(2-hydroxyphenyl)-1-(4-methylphenyl)prop-2-en-1-one
    • DTXSID20419372
    • NSC139719
    • SCHEMBL5084324
    • SCHEMBL5084329
    • NSC170283
    • (e)-3-(2-hydroxyphenyl)-1-(4-methylphenyl)-2-propen-1-one
    • Z56755769
    • NSC-170283
    • 7645-95-6
    • BS-3358
    • NSC-139719
    • 3-(2-hydroxyphenyl)-1-(4-methylphenyl)-2-propen-1-one
    • 81226-96-2
    • AKOS001025443
    • STL025239
    • Inchi： 1S/C16H14O2/c1-12-6-8-14(9-7-12)16(18)11-10-13-4-2-3-5-15(13)17/h2-11,17H,1H3/b11-10+
    • InChI Key： WWNBWYJVZCFWRS-ZHACJKMWSA-N
    • SMILES： OC1C=CC=CC=1/C=C/C(C1C=CC(C)=CC=1)=O

Computed Properties

  • Exact Mass: 238.099379685g/mol
  • Monoisotopic Mass: 238.099379685g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 3
  • Complexity: 300
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.7
  • Topological Polar Surface Area: 37.3?2

(2E)-3-(2-hydroxyphenyl)-1-(4-methylphenyl)prop-2-en-1-one Related Literature

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