Cas no 154214-55-8 (3H-Indolium, 2-[3-(1,3-dihydro-3,3-dimethyl-1-tetradecyl-2H-indol-2-ylidene)-1-propen-1-yl]-1-docosyl-3,3-dimethyl-, iodide (1:1))

3H-Indolium, 2-[3-(1,3-dihydro-3,3-dimethyl-1-tetradecyl-2H-indol-2-ylidene)-1-propen-1-yl]-1-docosyl-3,3-dimethyl-, iodide (1:1) structure
154214-55-8 structure
Product Name:3H-Indolium, 2-[3-(1,3-dihydro-3,3-dimethyl-1-tetradecyl-2H-indol-2-ylidene)-1-propen-1-yl]-1-docosyl-3,3-dimethyl-, iodide (1:1)
CAS No:154214-55-8
MF:C59H97IN2
MW:961.3
CID:191006
PubChem ID:162642097
Update Time:2024-11-04

3H-Indolium, 2-[3-(1,3-dihydro-3,3-dimethyl-1-tetradecyl-2H-indol-2-ylidene)-1-propen-1-yl]-1-docosyl-3,3-dimethyl-, iodide (1:1) Chemical and Physical Properties

Names and Identifiers

    • 3H-Indolium,2-[3-(1,3-dihydro-3,3-dimethyl-1-tetradecyl-2H-indol-2-ylidene)-1-propen-1-yl]-1-docosyl-3,3-dimethyl-,iodide (1:1)
    • 3H-Indolium,2-[3-(1,3-dihydro-3,3-dimethyl-1-tetradecyl-2H-indol-2-ylidene)-1-propen-1-yl]-1-docosyl-3,3-dimethyl-,iodide (1:
    • 3H-Indolium,2-[3-(1,3-dihydro-3,3-dimethyl-1-tetradecyl-2H-indol-2-ylidene)-1-propenyl]-1-docosyl-3,3-dimethyl-,iodide (9CI)
    • PKH 26
    • PKH 26GL
    • 3H-Indolium, 2-[3-(1,3-dihydro-3,3-dimethyl-1-tetradecyl-2H-indol-2-ylidene)-1-propen-1-yl]-1-docosyl-3,3-dimethyl-, iodide (1:1)
    • 154214-55-8
    • 2-[(E,3E)-3-(3,3-dimethyl-1-tetradecylindol-2-ylidene)prop-1-enyl]-1-docosyl-3,3-dimethylindol-1-ium;iodide
    • HY-D1451
    • PD167419
    • MS-31801
    • CS-0378565
    • Inchi: 1S/C59H97N2.HI/c1-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-30-32-34-36-42-51-61-55-47-40-38-45-53(55)59(5,6)57(61)49-43-48-56-58(3,4)52-44-37-39-46-54(52)60(56)50-41-35-33-31-29-20-18-16-14-12-10-8-2;/h37-40,43-49H,7-36,41-42,50-51H2,1-6H3;1H/q+1;/p-1
    • InChI Key: XOOOYQALQHJRCY-UHFFFAOYSA-M
    • SMILES: C([N+]1=C(C(C)(C)C2C=CC=CC1=2)C=CC=C1C(C2C=CC=CC=2N1CCCCCCCCCCCCCC)(C)C)CCCCCCCCCCCCCCCCCCCCC.[I-]

Computed Properties

  • Exact Mass: 960.66965g/mol
  • Monoisotopic Mass: 960.66965g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 62
  • Rotatable Bond Count: 36
  • Complexity: 1200
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 2
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 6.2?2

3H-Indolium, 2-[3-(1,3-dihydro-3,3-dimethyl-1-tetradecyl-2H-indol-2-ylidene)-1-propen-1-yl]-1-docosyl-3,3-dimethyl-, iodide (1:1) Pricemore >>

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3H-Indolium, 2-[3-(1,3-dihydro-3,3-dimethyl-1-tetradecyl-2H-indol-2-ylidene)-1-propen-1-yl]-1-docosyl-3,3-dimethyl-, iodide (1:1) Related Literature

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