Cas no 34465-83-3 ( )

  structure
  structure
Product Name: 
CAS No:34465-83-3
MF:C20H24O4
MW:328.402166366577
CID:919211
PubChem ID:5316012
Update Time:2025-04-19

  Chemical and Physical Properties

Names and Identifiers

    • COLLININ
    • 1-Piperazineethanol, 4-(3-(trifluoromethyl)phenyl)-
    • 2-(4-(3-(Trifluoromethyl)phenyl)-1-piperazinyl) ethanol
    • 2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethanol
    • 7-(3,4-dichloro-phenyl)-2,4,5,7-tetrahydro-3H-[1,3]diazepino[2,1-a]isoindol-7-ol
    • 7-(3,7-dimethyl-octa-2,6-dienyloxy)-8-methoxy-chromen-2-one
    • BRN 0618592
    • m-Trifluoro-methyl-4-phenyl-1-piperazinoethanol
    • 7-[[(2E)-3,7-dimethyl-2,6-octadien-1-yl]oxy]-8-methoxy-2H-1-benzopyran-2-one
    • (E)-7-((3,7-Dimethylocta-2,6-dien-1-yl)oxy)-8-methoxy-2H-chromen-2-one
    • NSC-31870
    • CHEMBL306908
    • NSC31870
    • HY-N8388
    • 34465-83-3
    • CS-0143841
    • AKOS040756361
    • 7-[(2E)-3,7-dimethylocta-2,6-dienoxy]-8-methoxychromen-2-one
    • 7-[(3,7-dimethylocta-2,6-dien-1-yl)oxy]-8-methoxy-2h-chromen-2-one
    • 7-((2E)-3,7-dimethylocta-2,6-dienoxy)-8-methoxychromen-2-one
    • DA-62447
    •  
    • Inchi: 1S/C20H24O4/c1-14(2)6-5-7-15(3)12-13-23-17-10-8-16-9-11-18(21)24-19(16)20(17)22-4/h6,8-12H,5,7,13H2,1-4H3/b15-12+
    • InChI Key: MJWGWXGEAHRWOV-NTCAYCPXSA-N
    • SMILES: O(C1=CC=C2C=CC(=O)OC2=C1OC)C/C=C(\C)/CC/C=C(\C)/C

Computed Properties

  • Exact Mass: 328.16752
  • Monoisotopic Mass: 328.167
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 24
  • Rotatable Bond Count: 7
  • Complexity: 514
  • 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
  • Topological Polar Surface Area: 44.8A^2
  • XLogP3: 5.2

Experimental Properties

  • Density: 1.092
  • Boiling Point: 487.1°C at 760 mmHg
  • Flash Point: 213.2°C
  • Refractive Index: 1.542
  • PSA: 44.76
  • LogP: 4.87310

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