Chemical Properties of Squalane (CAS 111-01-3)

Squalane

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InChI
InChI=1S/C30H62/c1-25(2)15-11-19-29(7)23-13-21-27(5)17-9-10-18-28(6)22-14-24-30(8)20-12-16-26(3)4/h25-30H,9-24H2,1-8H3
InChI Key
PRAKJMSDJKAYCZ-UHFFFAOYSA-N
Formula
C30H62
SMILES
CC(C)CCCC(C)CCCC(C)CCCCC(C)CCCC(C)CCCC(C)C
Molecular Weight1
422.81
CAS
111-01-3
Other Names
  • 2,6,10,15,19,23-Hexamethyltetracosane
  • Cosbiol
  • Dodecahydrosqualene
  • Hexamethyltetracosane
  • NSC 6851
  • Perhydrosqualene
  • Robane
  • Spinacane
  • Squalan
  • Squalane N
  • Tetracosane, 2,6,10,15,19,23-hexamethyl-
  • Vitabiosol
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Contents

  1. Physical Properties
  2. Temperature Dependent Properties
  3. Datasets
  4. Correlations
  5. Similar Compounds
  6. Mixtures
  7. Sources

Physical Properties

Property Value Unit Source
Δcliquid [-19801.30; -19800.60] kJ/mol Show Hide
Δcliquid -19801.30 ± 4.90 kJ/mol NIST
Δcliquid -19800.60 ± 1.90 kJ/mol NIST
Δf 187.08 kJ/mol Joback Calculated Property
Δfgas -694.21 kJ/mol Joback Calculated Property
Δfliquid [-865.40; -864.70] kJ/mol Show Hide
Δfliquid -864.70 ± 6.40 kJ/mol NIST
Δfliquid -865.40 ± 5.90 kJ/mol NIST
Δfus 52.32 kJ/mol Joback Calculated Property
Δvap 80.05 kJ/mol Joback Calculated Property
log10WS -10.93 Crippen Calculated Property
logPoct/wat 11.084 Crippen Calculated Property
McVol 433.560 ml/mol McGowan Calculated Property
Pc 700.00 kPa Vapor l...
Inp [2630.00; 2668.00]   Show Hide
Inp 2665.00 NIST
Inp 2666.00 NIST
Inp 2666.00 NIST
Inp 2667.00 NIST
Inp 2665.00 NIST
Inp 2666.00 NIST
Inp 2666.00 NIST
Inp 2666.00 NIST
Inp 2657.00 NIST
Inp 2657.00 NIST
Inp 2658.10 NIST
Inp 2658.50 NIST
Inp 2660.00 NIST
Inp 2664.40 NIST
Inp 2656.10 NIST
Inp 2663.00 NIST
Inp 2657.00 NIST
Inp 2668.00 NIST
Inp Outlier 2630.00 NIST
Inp 2663.00 NIST
Inp Outlier 2630.00 NIST
Inp Outlier 2632.00 NIST
Inp 2660.00 NIST
Inp 2668.00 NIST
Tboil 883.16 K Joback Calculated Property
Tc 1082.52 K Joback Calculated Property
Tfus 337.86 K Joback Calculated Property
Vc 1.679 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1484.10; 1621.11] J/mol×K [883.16; 1082.52] Show Hide
Cp,gas 1484.10 J/mol×K 883.16 Joback Calculated Property
Cp,gas 1510.47 J/mol×K 916.39 Joback Calculated Property
Cp,gas 1535.32 J/mol×K 949.61 Joback Calculated Property
Cp,gas 1558.73 J/mol×K 982.84 Joback Calculated Property
Cp,gas 1580.78 J/mol×K 1016.06 Joback Calculated Property
Cp,gas 1601.55 J/mol×K 1049.29 Joback Calculated Property
Cp,gas 1621.11 J/mol×K 1082.52 Joback Calculated Property
Cp,liquid 886.36 J/mol×K 298.15 NIST
η [0.0037800; 0.0602000] Pa×s [283.77; 362.98] Show Hide
η 0.0602000 Pa×s 283.77 Measure...
η 0.0461000 Pa×s 288.47 Measure...
η 0.0355900 Pa×s 293.29 Measure...
η 0.0279500 Pa×s 298.12 Measure...
η 0.0282570 Pa×s 298.15 Volumet...
η 0.0282570 Pa×s 298.15 Tempera...
η 0.0282570 Pa×s 298.15 Studies...
η 0.0224500 Pa×s 303.07 Measure...
η 0.0220870 Pa×s 303.15 Tempera...
η 0.0220870 Pa×s 303.15 Studies...
η 0.0220870 Pa×s 303.15 Volumet...
η 0.0183000 Pa×s 308.09 Measure...
η 0.0177740 Pa×s 308.15 Studies...
η 0.0177740 Pa×s 308.15 Volumet...
η 0.0177740 Pa×s 308.15 Tempera...
η 0.0150000 Pa×s 313.13 Measure...
η 0.0125000 Pa×s 318.17 Measure...
η 0.0105700 Pa×s 323.19 Measure...
η 0.0089900 Pa×s 328.26 Measure...
η 0.0078000 Pa×s 333.20 Measure...
η 0.0068100 Pa×s 338.18 Measure...
η 0.0060000 Pa×s 343.07 Measure...
η 0.0053200 Pa×s 348.08 Measure...
η 0.0047200 Pa×s 353.08 Measure...
η 0.0042000 Pa×s 358.13 Measure...
η 0.0037800 Pa×s 362.98 Measure...
ΔvapH 116.20 kJ/mol 438.00 NIST
n0 1.44740 298.15 Densiti...
ρl [764.06; 821.58] kg/m3 [273.15; 363.15] Show Hide
ρl 821.58 kg/m3 273.15 Tempera...
ρl 815.16 kg/m3 283.15 Tempera...
ρl 811.95 kg/m3 288.15 Tempera...
ρl 808.74 kg/m3 293.15 Tempera...
ρl 805.55 kg/m3 298.15 Tempera...
ρl 802.34 kg/m3 303.15 Tempera...
ρl 795.93 kg/m3 313.15 Tempera...
ρl 789.53 kg/m3 323.15 Tempera...
ρl 783.14 kg/m3 333.15 Tempera...
ρl 776.77 kg/m3 343.15 Tempera...
ρl 770.42 kg/m3 353.15 Tempera...
ρl 764.06 kg/m3 363.15 Tempera...
D*i [0.00; 0.00] m2/s [283.30; 362.88] Show Hide
D*i 0.00 m2/s 283.30 Viscous...
D*i 0.00 m2/s 288.28 Viscous...
D*i 0.00 m2/s 293.13 Viscous...
D*i 0.00 m2/s 293.19 Viscous...
D*i 0.00 m2/s 298.19 Viscous...
D*i 0.00 m2/s 298.44 Viscous...
D*i 0.00 m2/s 303.00 Viscous...
D*i 0.00 m2/s 303.18 Viscous...
D*i 0.00 m2/s 312.99 Viscous...
D*i 0.00 m2/s 322.69 Viscous...
D*i 0.00 m2/s 322.72 Viscous...
D*i 0.00 m2/s 323.16 Viscous...
D*i 0.00 m2/s 333.03 Viscous...
D*i 0.00 m2/s 333.49 Viscous...
D*i 0.00 m2/s 342.81 Viscous...
D*i 0.00 m2/s 348.20 Viscous...
D*i 0.00 m2/s 352.82 Viscous...
D*i 0.00 m2/s 353.15 Viscous...
D*i 0.00 m2/s 362.60 Viscous...
D*i 0.00 m2/s 362.82 Viscous...
D*i 0.00 m2/s 362.88 Viscous...

Datasets

  1. Molar heat capacity at constant pressure, J/K/mol (1)
  2. Viscosity, Pa*s (5)
  3. Mass density, kg/m3 (4)

Molar heat capacity at constant pressure, J/K/mol

Fixed Measured
Temperature, K - Liquid Pressure, kPa - Liquid Molar heat capacity at constant pressure, J/K/mol - Liquid
293.15 100.00 879.00
293.15 10000.00 873.50
293.15 20000.00 868.50
293.15 30000.00 865.50
313.15 100.00 904.40
313.15 10000.00 898.90
313.15 20000.00 896.40
313.15 30000.00 893.40
333.15 100.00 943.30
333.15 10000.00 940.80
333.15 20000.00 936.10
333.15 30000.00 929.30
353.15 100.00 978.80
353.15 10000.00 973.70
353.15 20000.00 963.20
353.15 30000.00 959.80
Reference

Viscosity, Pa*s

Fixed Measured
Temperature, K - Liquid Pressure, kPa - Liquid Viscosity, Pa*s - Liquid
273.15 100.00 0.1166
273.15 10000.00 0.1524
273.15 20000.00 0.1994
273.15 30000.00 0.2614
293.15 100.00 0.0353
293.15 10000.00 0.0436
293.15 20000.00 0.0540
293.15 30000.00 0.0656
313.15 100.00 0.0154
313.15 10000.00 0.0183
313.15 20000.00 0.0227
313.15 30000.00 0.0275
333.15 100.00 0.0078
333.15 10000.00 0.0094
333.15 20000.00 0.0110
333.15 30000.00 0.0131
Reference
Fixed Measured
Temperature, K - Liquid Pressure, kPa - Liquid Viscosity, Pa*s - Liquid
338.15 50600.00 0.0156
338.15 102800.00 0.0329
338.15 150200.00 0.0609
338.15 198400.00 0.1089
338.15 249700.00 0.1940
338.15 272700.00 0.2438
338.15 299800.00 0.3276
338.15 349200.00 0.5385
338.15 349200.00 0.5310
348.15 198300.00 0.0708
348.15 200400.00 0.0726
348.15 300600.00 0.2029
348.15 349800.00 0.3276
363.15 10200.00 0.0044
363.15 21000.00 0.0052
363.15 30900.00 0.0060
363.15 40700.00 0.0068
363.15 50600.00 0.0078
363.15 60600.00 0.0089
363.15 70700.00 0.0102
363.15 80600.00 0.0115
363.15 91000.00 0.0131
363.15 100000.00 0.0146
363.15 120400.00 0.0184
363.15 150300.00 0.0256
363.15 200200.00 0.0428
363.15 225600.00 0.0550
363.15 246900.00 0.0662
Reference
Fixed Measured
Temperature, K - Liquid Pressure, kPa - Liquid Viscosity, Pa*s - Liquid
303.15 10000.00 0.0274
303.15 15000.00 0.0308
303.15 25000.00 0.0382
303.15 50000.00 0.0627
303.15 75000.00 0.0985
303.15 100000.00 0.1508
303.15 125000.00 0.2274
303.15 150000.00 0.3395
313.15 10000.00 0.0184
313.15 15000.00 0.0204
313.15 25000.00 0.0248
313.15 50000.00 0.0391
313.15 75000.00 0.0595
313.15 100000.00 0.0887
313.15 125000.00 0.1303
313.15 150000.00 0.1898
323.15 10000.00 0.0130
323.15 15000.00 0.0143
323.15 25000.00 0.0171
323.15 50000.00 0.0261
323.15 75000.00 0.0387
323.15 100000.00 0.0563
323.15 125000.00 0.0809
323.15 150000.00 0.1154
333.15 10000.00 0.0092
333.15 15000.00 0.0101
333.15 25000.00 0.0121
333.15 50000.00 0.0182
333.15 75000.00 0.0265
333.15 100000.00 0.0378
333.15 125000.00 0.0532
333.15 150000.00 0.0740
343.15 10000.00 0.0070
343.15 15000.00 0.0076
343.15 25000.00 0.0090
343.15 50000.00 0.0133
343.15 75000.00 0.0190
343.15 100000.00 0.0267
343.15 125000.00 0.0370
343.15 150000.00 0.0508
353.15 10000.00 0.0054
353.15 15000.00 0.0059
353.15 25000.00 0.0069
353.15 50000.00 0.0101
353.15 75000.00 0.0142
353.15 100000.00 0.0195
353.15 125000.00 0.0264
353.15 150000.00 0.0355
Reference
Fixed Measured
Temperature, K - Liquid Pressure, kPa - Liquid Viscosity, Pa*s - Liquid
303.15 10000.00 0.0281
303.15 15000.00 0.0314
303.15 25000.00 0.0387
303.15 50000.00 0.0623
303.15 75000.00 0.0975
303.15 100000.00 0.1497
303.15 125000.00 0.2270
303.15 150000.00 0.3410
313.15 10000.00 0.0182
313.15 15000.00 0.0203
313.15 25000.00 0.0249
313.15 50000.00 0.0398
313.15 75000.00 0.0610
313.15 100000.00 0.0913
313.15 125000.00 0.1346
313.15 150000.00 0.1964
343.15 10000.00 0.0073
343.15 15000.00 0.0079
343.15 25000.00 0.0093
343.15 50000.00 0.0136
343.15 75000.00 0.0193
343.15 100000.00 0.0270
343.15 125000.00 0.0372
343.15 150000.00 0.0510
353.15 10000.00 0.0056
353.15 15000.00 0.0060
353.15 25000.00 0.0070
353.15 50000.00 0.0101
353.15 75000.00 0.0140
353.15 100000.00 0.0193
353.15 125000.00 0.0263
353.15 150000.00 0.0356
Reference
Fixed Measured
Temperature, K - Liquid Pressure, kPa - Liquid Viscosity, Pa*s - Liquid
303.18 1070.00 0.0220
303.18 5300.00 0.0242
303.18 5740.00 0.0244
303.18 15580.00 0.0303
303.18 25530.00 0.0369
303.18 35790.00 0.0443
303.18 45770.00 0.0546
303.18 55770.00 0.0663
348.13 5270.00 0.0056
348.13 5290.00 0.0056
348.13 25490.00 0.0078
348.13 56280.00 0.0123
348.13 85860.00 0.0184
348.13 115830.00 0.0269
348.13 145930.00 0.0387
348.13 175120.00 0.0556
398.15 5160.00 0.0022
398.15 5230.00 0.0022
398.15 25310.00 0.0029
398.15 56100.00 0.0042
398.15 85890.00 0.0059
398.15 115450.00 0.0079
398.15 145820.00 0.0106
398.15 176100.00 0.0138
448.25 5580.00 0.0012
448.25 5730.00 0.0012
448.25 25470.00 0.0015
448.25 55510.00 0.0022
448.25 85620.00 0.0029
448.25 115510.00 0.0038
448.25 145580.00 0.0048
448.25 176050.00 0.0060
Reference

Mass density, kg/m3

Fixed Measured
Pressure, kPa - Liquid Temperature, K - Liquid Mass density, kg/m3 - Liquid
100.00 298.15 804.9
1000.00 298.15 805.4
5000.00 298.15 807.8
10000.00 298.15 810.7
15000.00 298.15 813.4
20000.00 298.15 816.1
30000.00 298.15 821.2
40000.00 298.15 826.0
45000.00 298.15 828.3
50000.00 298.15 830.5
60000.00 298.15 834.8
100.00 323.15 789.0
1000.00 323.15 789.6
5000.00 323.15 792.3
10000.00 323.15 795.5
15000.00 323.15 798.6
20000.00 323.15 801.5
30000.00 323.15 807.1
40000.00 323.15 812.3
45000.00 323.15 814.8
50000.00 323.15 817.2
60000.00 323.15 821.9
100.00 348.15 773.0
1000.00 348.15 773.7
5000.00 348.15 776.7
10000.00 348.15 780.3
15000.00 348.15 783.7
20000.00 348.15 787.0
30000.00 348.15 793.2
40000.00 348.15 799.0
45000.00 348.15 801.7
50000.00 348.15 804.3
60000.00 348.15 809.3
1000.00 373.15 758.0
5000.00 373.15 761.3
10000.00 373.15 765.3
15000.00 373.15 769.1
20000.00 373.15 772.7
30000.00 373.15 779.5
40000.00 373.15 785.8
45000.00 373.15 788.7
50000.00 373.15 791.6
60000.00 373.15 797.1
1000.00 398.15 742.1
5000.00 398.15 745.9
10000.00 398.15 750.4
15000.00 398.15 754.6
20000.00 398.15 758.6
30000.00 398.15 766.1
40000.00 398.15 772.9
45000.00 398.15 776.1
50000.00 398.15 779.1
60000.00 398.15 785.0
Reference
Fixed Measured
Temperature, K - Liquid Pressure, kPa - Liquid Mass density, kg/m3 - Liquid
313.15 5700.00 798.1
313.15 13500.00 804.3
313.15 23500.00 811.4
313.15 45700.00 822.6
313.15 68000.00 832.5
338.15 7900.00 783.2
338.15 11000.00 785.2
338.15 22500.00 793.3
338.15 45600.00 807.5
338.15 60500.00 814.6
338.15 76300.00 820.5
363.15 10600.00 769.9
363.15 21500.00 777.9
363.15 42500.00 791.1
363.15 63700.00 802.4
Reference
Fixed Measured
Temperature, K - Liquid Pressure, kPa - Liquid Mass density, kg/m3 - Liquid
278.15 100.00 818.1
278.15 1000.00 818.59
278.15 5000.00 820.71
278.15 10000.00 823.31
278.15 15000.00 825.81
278.15 20000.00 828.24
278.15 25000.00 830.59
278.15 30000.00 832.87
278.15 35000.00 835.07
278.15 40000.00 837.21
278.15 45000.00 839.31
283.15 100.00 814.75
283.15 1000.00 815.25
283.15 5000.00 817.45
283.15 10000.00 820.16
283.15 15000.00 822.72
283.15 20000.00 825.21
283.15 25000.00 827.62
283.15 30000.00 829.94
283.15 35000.00 832.23
283.15 40000.00 834.41
283.15 45000.00 836.54
293.15 100.00 808.27
293.15 1000.00 808.81
293.15 5000.00 811.1
293.15 10000.00 813.88
293.15 15000.00 816.58
293.15 20000.00 819.18
293.15 25000.00 821.67
293.15 30000.00 824.14
293.15 35000.00 826.49
293.15 40000.00 828.81
293.15 45000.00 831.04
303.15 100.00 801.88
303.15 1000.00 802.43
303.15 5000.00 804.87
303.15 10000.00 807.78
303.15 15000.00 810.59
303.15 20000.00 813.29
303.15 25000.00 815.92
303.15 30000.00 818.45
303.15 35000.00 820.92
303.15 40000.00 823.29
303.15 45000.00 825.61
313.15 100.00 795.53
313.15 1000.00 796.12
313.15 5000.00 798.64
313.15 10000.00 801.68
313.15 15000.00 804.61
313.15 20000.00 807.43
313.15 25000.00 810.22
313.15 30000.00 812.78
313.15 35000.00 815.35
313.15 40000.00 817.81
313.15 45000.00 820.22
323.15 100.00 789.06
323.15 1000.00 789.69
323.15 5000.00 792.34
323.15 10000.00 795.54
323.15 15000.00 798.63
323.15 20000.00 801.58
323.15 25000.00 804.45
323.15 30000.00 807.17
323.15 35000.00 809.84
323.15 40000.00 812.42
323.15 45000.00 814.91
333.15 100.00 782.73
333.15 1000.00 783.37
333.15 5000.00 786.19
333.15 10000.00 789.56
333.15 15000.00 792.76
333.15 20000.00 795.83
333.15 25000.00 798.79
333.15 30000.00 801.62
333.15 35000.00 804.39
333.15 40000.00 807.03
333.15 45000.00 809.62
343.15 100.00 776.31
343.15 1000.00 777.0
343.15 5000.00 779.93
343.15 10000.00 783.45
343.15 15000.00 786.81
343.15 20000.00 790.03
343.15 25000.00 793.12
343.15 30000.00 796.08
343.15 35000.00 798.94
343.15 40000.00 801.71
343.15 45000.00 804.4
353.15 100.00 770.03
353.15 1000.00 770.73
353.15 5000.00 773.84
353.15 10000.00 777.5
353.15 15000.00 781.02
353.15 20000.00 784.36
353.15 25000.00 787.57
353.15 30000.00 790.66
353.15 35000.00 793.62
353.15 40000.00 796.47
353.15 45000.00 799.24
Reference
Fixed Measured
Temperature, K - Liquid Pressure, kPa - Liquid Mass density, kg/m3 - Liquid
338.19 1050.00 779.26
338.19 21210.00 792.77
338.20 40640.00 803.93
338.20 60420.00 814.29
338.20 79830.00 822.46
338.20 100230.00 831.55
338.21 119820.00 837.96
338.20 140240.00 845.12
338.20 161300.00 851.46
338.22 940.00 778.91
373.12 780.00 756.09
373.12 20350.00 771.55
373.12 39970.00 784.5
373.12 60030.00 795.89
373.12 80950.00 806.36
373.12 101160.00 815.48
373.12 120420.00 823.57
373.12 140640.00 831.1
373.12 159510.00 837.61
373.12 180460.00 843.98
373.12 201380.00 850.63
373.12 620.00 756.02
388.14 1100.00 746.78
388.13 20290.00 762.98
388.14 40380.00 776.95
388.14 59850.00 788.53
388.13 80490.00 799.25
388.13 101530.00 809.12
388.13 120960.00 817.16
388.13 139900.00 824.59
388.14 160800.00 832.35
388.14 180610.00 838.96
388.14 201470.00 845.55
388.13 890.00 746.65
413.17 1050.00 730.56
413.18 20110.00 748.65
413.18 40280.00 763.94
413.18 60200.00 776.68
413.21 80740.00 788.16
413.22 100350.00 797.82
413.22 120460.00 806.56
413.24 140200.00 815.07
413.25 160570.00 822.8
413.25 181450.00 829.85
413.25 202090.00 836.75
413.24 610.00 730.1
433.36 680.00 717.22
433.31 600.00 717.04
433.35 20500.00 737.74
433.36 40310.00 753.83
433.19 60430.00 767.55
433.20 80190.00 779.13
433.21 100280.00 789.84
433.21 120040.00 798.72
433.21 140200.00 807.55
433.19 160660.00 815.65
433.19 180700.00 823.09
433.19 200370.00 830.05
433.18 1120.00 717.8
453.15 1150.00 704.74
453.16 20190.00 726.4
453.17 40450.00 744.09
453.18 60480.00 758.43
453.18 80140.00 770.59
453.18 100410.00 781.58
453.20 120790.00 791.61
453.20 140400.00 800.32
453.19 160150.00 808.49
453.20 180710.00 816.55
338.29 1010.00 779.46
452.95 163170.00 809.3
452.95 180270.00 815.84
452.85 201770.00 823.37
473.05 150.00 690.19
472.81 1050.00 691.59
473.05 20040.00 715.2
473.05 39890.00 733.71
473.06 60230.00 749.17
473.06 79910.00 761.86
473.07 100370.00 773.42
473.05 120200.00 783.48
473.05 140440.00 792.71
473.05 160340.00 801.0
473.05 180470.00 808.83
473.03 200210.00 815.83
473.04 1050.00 691.45
Reference

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.66] kPa [556.00; 747.17] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.62095e+01
Coefficient B-6.60264e+03
Coefficient C-1.41310e+02
Temperature range, min.556.00
Temperature range, max.747.17
Pvap 1.33 kPa 556.00 Calculated Property
Pvap 2.90 kPa 577.24 Calculated Property
Pvap 5.85 kPa 598.48 Calculated Property
Pvap 11.12 kPa 619.72 Calculated Property
Pvap 19.99 kPa 640.96 Calculated Property
Pvap 34.26 kPa 662.21 Calculated Property
Pvap 56.29 kPa 683.45 Calculated Property
Pvap 89.10 kPa 704.69 Calculated Property
Pvap 136.39 kPa 725.93 Calculated Property
Pvap 202.66 kPa 747.17 Calculated Property

Similar Compounds

Octacosane, 2,6,10,14,19,23,27-heptamethyl. Cyclodecane, methyl-. Tricosane, 2,6,10,14,18,22-hexamethyl. Cyclononane, methyl. Dodecane, 2,6,11-trimethyl-. cis-1,5-Dimethylcyclooctane. Pentadecane, 2,6,10,14-tetramethyl-. trans-1,5-Dimethylcyclooctane. Cyclooctane, 1,5-dimethyl-. Heptacosane, 2,6,10,14,18,22,26-heptamethyl. Hentriacontane, 2,6,10,14,18,22,26,30-octamethyl. Nonadecane, 2,6,10,14,18-pentamethyl-. Cyclooctane, methyl-. Hexadecane, 2,6,10,15-tetramethyl. Methylcycloundecane.

Find more compounds similar to Squalane.

Mixtures

Sources

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.