3,3′-Dioctadecyloxacarbocyanine perchlorate
C53H85N2O2.ClO4
34215-57-1 Copyright (C) 2025 ACS
 62 64  0  0  0  0  0  0  0  0999 V2000
   12.0033   23.8701    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6695   23.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6695   21.5600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3358   20.7900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3358   19.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0022   18.4800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0022   16.9400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6685   16.1700    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6685   14.6300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3347   13.8600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3347   12.3200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0011   11.5500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0011   10.0100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6674    9.2400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6674    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3338    6.9300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3338    5.3900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.6200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7137   25.8393    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8582   26.8698    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3227   26.3940    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.6000   25.6973    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.1316   25.5363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.7579   24.1295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.2896   23.9685    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.9159   22.5617    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.4474   22.4007    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.0737   20.9938    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   28.6054   20.8329    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.2317   19.4259    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   30.7633   19.2650    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   31.3897   17.8582    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   32.9213   17.6971    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   33.5476   16.2903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   35.0791   16.1294    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   35.7056   14.7224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   37.2371   14.5615    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   37.8635   13.1545    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   39.3952   12.9936    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7572   26.3153    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0033   25.4101    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.2333   27.7798    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2510   25.9951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2491   26.3153    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7733   27.7798    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.2027   28.9243    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2205   27.1395    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6964   28.6042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.4673   27.4244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.9735   27.1042    0.0000 N   0  3  0  0  0  4  0  0  0  0  0  0
   18.3063   28.9559    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.7435   28.4379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.7131   29.5824    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.2500   28.7580    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.1890   31.0469    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.7258   30.2227    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.6954   31.3671    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.6976    1.5400    0.0000 Cl  0  0  0  0  0  7  0  0  0  0  0  0
   18.1576    1.5400    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.2376    1.5400    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.6976    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.6976    3.0800    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 41  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 19 20  1  0  0  0  0
 19 44  2  3  0  0  0
 20 21  2  3  0  0  0
 21 49  1  0  0  0  0
 22 23  1  0  0  0  0
 22 50  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
 31 32  1  0  0  0  0
 32 33  1  0  0  0  0
 33 34  1  0  0  0  0
 34 35  1  0  0  0  0
 35 36  1  0  0  0  0
 36 37  1  0  0  0  0
 37 38  1  0  0  0  0
 38 39  1  0  0  0  0
 40 41  1  0  0  0  0
 40 42  1  0  0  0  0
 40 43  2  0  0  0  0
 41 44  1  0  0  0  0
 42 45  1  0  0  0  0
 42 46  2  0  0  0  0
 43 47  1  0  0  0  0
 44 45  1  0  0  0  0
 46 48  1  0  0  0  0
 47 48  2  0  0  0  0
 49 50  2  0  0  0  0
 49 51  1  0  0  0  0
 50 52  1  0  0  0  0
 51 53  1  0  0  0  0
 52 53  1  0  0  0  0
 52 54  2  0  0  0  0
 53 55  2  0  0  0  0
 54 56  1  0  0  0  0
 55 57  1  0  0  0  0
 56 57  2  0  0  0  0
 58 59  2  0  0  0  0
 58 60  2  0  0  0  0
 58 61  2  0  0  0  0
 58 62  1  0  0  0  0
M  CHG  2  50   1  62  -1
M  END
> <cas.rn>
34215-57-1

> <cas.index.name>
Benzoxazolium, 3-octadecyl-2-[3-(3-octadecyl-2(3H)-benzoxazolylidene)-1-propen-1-yl]-, perchlorate (1:1)

> <molecular.formula>
C53H85N2O2.ClO4

> <molecular.weight>
881.71

$$$$
