Chemical Properties of 1-Octene (CAS 111-66-0)

1-Octene

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InChI
InChI=1S/C8H16/c1-3-5-7-8-6-4-2/h3H,1,4-8H2,2H3
InChI Key
KWKAKUADMBZCLK-UHFFFAOYSA-N
Formula
C8H16
SMILES
C=CCCCCCC
Molecular Weight1
112.21
CAS
111-66-0
Other Names
  • 1-C8H16
  • 1-n-Octene
  • CAPRYLENE
  • N-1-OCTENE
  • NSC 8457
  • Neodene 8
  • Oct-1-ene
  • Octene-1
  • Octylene
  • SHOP C8
  • «alpha»-Octene
  • «alpha»-Octylene
  • «alpha»-Octene
  • «alpha»-Octylene
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Physical Properties

Property Value Unit Source
ω 0.3860 KDB
Tig 529.26 K KDB
AP 305.650 K KDB
Δcliquid -5312.90 ± 1.10 kJ/mol NIST
μ 0.30 debye KDB
LFL 0.90 % in Air KDB
Tflash,cc 294.26 K KDB
Δf 104.30 kJ/mol KDB
Δc,grossH 5312.93 kJ/mol KDB
Δc,netH 4960.844 kJ/mol KDB
Δfgas [-82.98; -82.93] kJ/mol Show Hide
Δfgas -82.98 kJ/mol KDB
Δfgas -82.93 kJ/mol NIST
Δfgas -82.93 kJ/mol NIST
Δfliquid -121.80 ± 1.20 kJ/mol NIST
Δfus 15.20 kJ/mol Joback Calculated Property
Δvap [38.00; 40.60] kJ/mol Show Hide
Δvap 40.44 kJ/mol NIST
Δvap 40.60 kJ/mol NIST
Δvap 40.27 ± 0.20 kJ/mol NIST
Δvap 40.30 ± 0.20 kJ/mol NIST
Δvap 38.00 kJ/mol NIST
IE [9.43; 9.60] eV Show Hide
IE 9.43 ± 0.01 eV NIST
IE 9.43 ± 0.01 eV NIST
IE 9.43 ± 0.01 eV NIST
IE 9.60 ± 0.01 eV NIST
log10WS [-4.44; -4.44]   Show Hide
log10WS -4.44 Aq. Sol...
log10WS -4.44 Estimat...
logPoct/wat 3.143 Crippen Calculated Property
McVol 119.280 ml/mol McGowan Calculated Property
NFPA Fire 3 KDB
NFPA Health 1 KDB
Pc [2680.00; 2680.00] kPa Show Hide
Pc 2680.00 kPa KDB
Pc 2680.00 ± 80.00 kPa NIST
ρc 235.65 ± 8.98 kg/m3 NIST
Inp [779.00; 799.00]   Show Hide
Inp 786.00 NIST
Inp 788.30 NIST
Inp 780.40 NIST
Inp 784.90 NIST
Inp 783.00 NIST
Inp 789.00 NIST
Inp 788.00 NIST
Inp 780.00 NIST
Inp 785.30 NIST
Inp 786.00 NIST
Inp 788.00 NIST
Inp 789.00 NIST
Inp 788.00 NIST
Inp 789.00 NIST
Inp 789.00 NIST
Inp 789.00 NIST
Inp 788.30 NIST
Inp 789.00 NIST
Inp 781.00 NIST
Inp 781.80 NIST
Inp 789.00 NIST
Inp 788.00 NIST
Inp 788.00 NIST
Inp 788.00 NIST
Inp 790.00 NIST
Inp 792.50 NIST
Inp 792.60 NIST
Inp 792.70 NIST
Inp 792.80 NIST
Inp 792.90 NIST
Inp 793.00 NIST
Inp 790.00 NIST
Inp 789.00 NIST
Inp 789.00 NIST
Inp 788.40 NIST
Inp 788.60 NIST
Inp 788.80 NIST
Inp 789.00 NIST
Inp 786.70 NIST
Inp 789.40 NIST
Inp 788.10 NIST
Inp 787.70 NIST
Inp 787.60 NIST
Inp 787.30 NIST
Inp 787.00 NIST
Inp 786.60 NIST
Inp 790.00 NIST
Inp 781.60 NIST
Inp 782.00 NIST
Inp 781.00 NIST
Inp 782.60 NIST
Inp 784.00 NIST
Inp 783.70 NIST
Inp 782.00 NIST
Inp 782.00 NIST
Inp 784.00 NIST
Inp 784.00 NIST
Inp 781.00 NIST
Inp 782.00 NIST
Inp 788.00 NIST
Inp 788.00 NIST
Inp 782.67 NIST
Inp 782.67 NIST
Inp 782.70 NIST
Inp 783.00 NIST
Inp 783.00 NIST
Inp 782.00 NIST
Inp 789.20 NIST
Inp 781.40 NIST
Inp 781.00 NIST
Inp 782.90 NIST
Inp 782.30 NIST
Inp 783.00 NIST
Inp 786.00 NIST
Inp 790.00 NIST
Inp 782.00 NIST
Inp 783.00 NIST
Inp Outlier 779.00 NIST
Inp 785.00 NIST
Inp 790.00 NIST
Inp 790.00 NIST
Inp 791.00 NIST
Inp 795.00 NIST
Inp 786.00 NIST
Inp Outlier 796.00 NIST
Inp 787.72 NIST
Inp 790.00 NIST
Inp 792.90 NIST
Inp 789.00 NIST
Inp 794.00 NIST
Inp 792.00 NIST
Inp 785.00 NIST
Inp 782.40 NIST
Inp 789.30 NIST
Inp 788.40 NIST
Inp 788.30 NIST
Inp 789.30 NIST
Inp 789.10 NIST
Inp 789.60 NIST
Inp 788.40 NIST
Inp 785.00 NIST
Inp 789.70 NIST
Inp 788.30 NIST
Inp 789.30 NIST
Inp 789.10 NIST
Inp 789.30 NIST
Inp 788.40 NIST
Inp 787.00 NIST
Inp 787.00 NIST
Inp 789.04 NIST
Inp 788.99 NIST
Inp 789.05 NIST
Inp 791.72 NIST
Inp 791.76 NIST
Inp 791.77 NIST
Inp 786.00 NIST
Inp Outlier 799.00 NIST
Inp 789.00 NIST
Inp 792.00 NIST
Inp 782.00 NIST
Inp 782.00 NIST
Inp 782.00 NIST
Inp 787.00 NIST
Inp 792.00 NIST
Inp 787.00 NIST
Inp 789.00 NIST
Inp 792.00 NIST
Inp Outlier 796.00 NIST
Inp 790.00 NIST
Inp 791.00 NIST
Inp 793.00 NIST
Inp 792.00 NIST
Inp 794.00 NIST
Inp 786.00 NIST
Inp 788.00 NIST
Inp 788.00 NIST
Inp 788.00 NIST
Inp 788.00 NIST
Inp 790.00 NIST
Inp 794.00 NIST
Inp Outlier 799.00 NIST
Inp 783.00 NIST
Inp 785.00 NIST
Inp Outlier 799.00 NIST
Inp 788.20 NIST
Inp 788.04 NIST
Inp 792.00 NIST
Inp 788.00 NIST
Inp 789.00 NIST
Inp 792.00 NIST
Inp 791.00 NIST
Inp 791.00 NIST
Inp 792.00 NIST
Inp 789.00 NIST
Inp 788.00 NIST
Inp 788.00 NIST
Inp Outlier 779.00 NIST
Inp 792.00 NIST
Inp 788.00 NIST
Inp 788.00 NIST
Inp 783.00 NIST
Inp 792.00 NIST
Inp 793.00 NIST
Inp 788.00 NIST
Inp 790.00 NIST
Inp 790.00 NIST
Inp 789.00 NIST
Inp 788.00 NIST
Inp 784.00 NIST
Inp 792.00 NIST
Inp 792.00 NIST
Inp Outlier 797.00 NIST
Inp 783.00 NIST
Inp 790.00 NIST
Inp 784.90 NIST
Inp 783.00 NIST
Inp 788.00 NIST
Inp 787.00 NIST
Inp 790.00 NIST
Inp 788.00 NIST
Inp 788.00 NIST
Inp 795.00 NIST
Inp 790.00 NIST
Inp 790.00 NIST
Inp 786.00 NIST
Inp 785.00 NIST
Inp 785.00 NIST
Inp 786.00 NIST
Inp 782.00 NIST
I [822.00; 892.00]   Show Hide
I 851.00 NIST
I 852.00 NIST
I 847.00 NIST
I 847.00 NIST
I 850.00 NIST
I 848.50 NIST
I 847.40 NIST
I 847.20 NIST
I 849.90 NIST
I 847.20 NIST
I 848.50 NIST
I 847.40 NIST
I 849.90 NIST
I 842.00 NIST
I 837.00 NIST
I 833.00 NIST
I 836.00 NIST
I 837.00 NIST
I Outlier 892.00 NIST
I 850.00 NIST
I 822.00 NIST
I 830.00 NIST
I 830.00 NIST
I 831.00 NIST
I 830.00 NIST
I 836.00 NIST
liquid 360.45 J/mol×K NIST
Tboil 394.44 K KDB
Tc [566.55; 567.00] K Show Hide
Tc 567.00 K KDB
Tc 567.00 ± 0.80 K NIST
Tc 566.60 K NIST
Tc 566.55 ± 0.05 K NIST
Tfus [167.15; 171.44] K Show Hide
Tfus 171.40 K KDB
Tfus 171.25 K Aq. Sol...
Tfus 171.31 ± 0.20 K NIST
Tfus 171.43 ± 0.05 K NIST
Tfus 171.44 ± 0.03 K NIST
Tfus 171.20 ± 1.00 K NIST
Tfus 171.44 ± 0.03 K NIST
Tfus 171.40 ± 0.06 K NIST
Tfus 171.09 ± 0.10 K NIST
Tfus 171.05 ± 0.40 K NIST
Tfus Outlier 167.15 ± 1.50 K NIST
Tfus 171.04 ± 0.30 K NIST
Ttriple 171.46 ± 0.05 K NIST
Vc [0.468; 0.468] m3/kmol Show Hide
Vc 0.468 m3/kmol KDB
Vc 0.468 m3/kmol NIST
Zc 0.2660490 KDB
Zra 0.26 KDB

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [217.72; 285.74] J/mol×K [379.12; 545.88] Show Hide
Cp,gas 217.72 J/mol×K 379.12 Joback Calculated Property
Cp,gas 230.22 J/mol×K 406.91 Joback Calculated Property
Cp,gas 242.23 J/mol×K 434.71 Joback Calculated Property
Cp,gas 253.77 J/mol×K 462.50 Joback Calculated Property
Cp,gas 264.86 J/mol×K 490.29 Joback Calculated Property
Cp,gas 275.52 J/mol×K 518.08 Joback Calculated Property
Cp,gas 285.74 J/mol×K 545.88 Joback Calculated Property
Cp,liquid 241.21 J/mol×K 298.15 NIST
η [0.0002381; 0.0046461] Pa×s [178.16; 379.12] Show Hide
η 0.0046461 Pa×s 178.16 Joback Calculated Property
η 0.0019138 Pa×s 211.65 Joback Calculated Property
η 0.0010045 Pa×s 245.15 Joback Calculated Property
η 0.0006156 Pa×s 278.64 Joback Calculated Property
η 0.0004191 Pa×s 312.13 Joback Calculated Property
η 0.0003074 Pa×s 345.63 Joback Calculated Property
η 0.0002381 Pa×s 379.12 Joback Calculated Property
ΔfusH [15.31; 15.31] kJ/mol [171.46; 171.50] Show Hide
ΔfusH 15.31 kJ/mol 171.46 NIST
ΔfusH 15.31 kJ/mol 171.50 NIST
ΔfusH 15.31 kJ/mol 171.50 NIST
ΔvapH [33.77; 41.20] kJ/mol [275.50; 395.20] Show Hide
ΔvapH 41.20 kJ/mol 275.50 NIST
ΔvapH 40.20 kJ/mol 277.00 NIST
ΔvapH 39.50 ± 0.10 kJ/mol 313.00 NIST
ΔvapH 38.60 ± 0.10 kJ/mol 328.00 NIST
ΔvapH 37.60 ± 0.10 kJ/mol 343.00 NIST
ΔvapH 38.80 kJ/mol 356.00 NIST
ΔvapH 36.60 ± 0.10 kJ/mol 358.00 NIST
ΔvapH 35.80 ± 0.10 kJ/mol 368.00 NIST
ΔvapH 34.07 kJ/mol 394.40 NIST
ΔvapH 33.77 kJ/mol 395.20 KDB
Pvap [8.30; 165.90] kPa [323.15; 413.15] Show Hide
Pvap 8.30 kPa 323.15 Isother...
Pvap 10.12 kPa 328.15 Vapor L...
Pvap 38.51 kPa 363.15 Measure...
Pvap 39.20 kPa 363.15 Vapor L...
Pvap 53.82 kPa 373.10 Phase E...
Pvap 165.90 kPa 413.15 Phase E...
n0 1.40620 298.15 KDB
ρl [710.88; 715.00] kg/m3 [293.00; 298.15] Show Hide
ρl 715.00 kg/m3 293.00 KDB
ρl 710.88 kg/m3 298.15 Excess ...
D*i [2.28e-07; 3.44e-07] m2/s [298.15; 323.15] Show Hide
D*i 2.28e-07 m2/s 298.15 Viscosi...
D*i 3.44e-07 m2/s 323.15 Viscosi...
ΔfusS 89.31 J/mol×K 171.46 NIST
γ [0.02; 0.02] N/m [283.10; 348.15] Show Hide
γ 0.02 N/m 283.10 Phase E...
γ 0.02 N/m 298.15 Phase E...
γ 0.02 N/m 298.20 KDB
γ 0.02 N/m 323.15 Phase E...
γ 0.02 N/m 348.15 Phase E...
λ [0.12; 0.14] W/m×K [259.69; 326.87] Show Hide
λ 0.14 W/m×K 259.69 Thermal...
λ 0.14 W/m×K 259.90 Thermal...
λ 0.14 W/m×K 260.06 Thermal...
λ 0.13 W/m×K 279.34 Thermal...
λ 0.13 W/m×K 279.57 Thermal...
λ 0.13 W/m×K 279.72 Thermal...
λ 0.12 W/m×K 296.88 Thermal...
λ 0.12 W/m×K 297.14 Thermal...
λ 0.12 W/m×K 297.28 Thermal...
λ 0.12 W/m×K 315.82 Thermal...
λ 0.12 W/m×K 316.07 Thermal...
λ 0.12 W/m×K 316.24 Thermal...
λ 0.12 W/m×K 326.44 Thermal...
λ 0.12 W/m×K 326.70 Thermal...
λ 0.12 W/m×K 326.87 Thermal...

Datasets

Thermal conductivity, W/m/K

Fixed Measured
Temperature, K - Liquid Pressure, kPa - Liquid Thermal conductivity, W/m/K - Liquid
254.47 100.00 0.1381
254.41 5000.00 0.1402
254.47 10000.00 0.1426
254.35 20000.00 0.1464
254.35 30000.00 0.1500
274.46 100.00 0.1302
274.44 5000.00 0.1324
274.50 10000.00 0.1349
274.59 20000.00 0.1394
274.44 30000.00 0.1439
294.91 100.00 0.1254
294.90 5200.00 0.1277
294.85 10100.00 0.1300
294.79 20000.00 0.1341
294.76 30000.00 0.1379
314.65 100.00 0.1200
314.61 5000.00 0.1228
314.59 10000.00 0.1249
314.61 20000.00 0.1291
314.51 30000.00 0.1331
334.94 100.00 0.1140
334.82 5100.00 0.1167
334.82 10000.00 0.1191
334.69 20000.00 0.1238
334.71 30000.00 0.1282
355.05 100.00 0.1078
354.89 5100.00 0.1106
354.72 10000.00 0.1137
354.74 20000.00 0.1186
354.64 30000.00 0.1234
374.48 600.00 0.1023
375.03 5100.00 0.1047
374.83 10000.00 0.1077
374.86 20100.00 0.1135
374.80 30000.00 0.1179
Reference

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.63] kPa [287.65; 421.80] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.42819e+01
Coefficient B-3.35220e+03
Coefficient C-4.81090e+01
Temperature range, min.287.65
Temperature range, max.421.80
Pvap 1.33 kPa 287.65 Calculated Property
Pvap 3.03 kPa 302.56 Calculated Property
Pvap 6.27 kPa 317.46 Calculated Property
Pvap 12.05 kPa 332.37 Calculated Property
Pvap 21.69 kPa 347.27 Calculated Property
Pvap 36.91 kPa 362.18 Calculated Property
Pvap 59.86 kPa 377.08 Calculated Property
Pvap 93.10 kPa 391.99 Calculated Property
Pvap 139.59 kPa 406.89 Calculated Property
Pvap 202.63 kPa 421.80 Calculated Property
Pvap [2.43e-06; 2579.57] kPa [171.45; 566.60] KDB Vap... Show Hide
Equationln(Pvp) = A + B/T + C*ln(T) + D*T^2
Coefficient A9.67823e+01
Coefficient B-8.07486e+03
Coefficient C-1.22214e+01
Coefficient D8.73474e-06
Temperature range, min.171.45
Temperature range, max.566.60
Pvap 2.43e-06 kPa 171.45 Calculated Property
Pvap 2.57e-03 kPa 215.36 Calculated Property
Pvap 0.18 kPa 259.26 Calculated Property
Pvap 3.04 kPa 303.17 Calculated Property
Pvap 21.74 kPa 347.07 Calculated Property
Pvap 91.75 kPa 390.98 Calculated Property
Pvap 275.95 kPa 434.88 Calculated Property
Pvap 663.70 kPa 478.79 Calculated Property
Pvap 1375.08 kPa 522.69 Calculated Property
Pvap 2579.57 kPa 566.60 Calculated Property

Similar Compounds

1-Nonacosene. 1-Decene. Hexadecene. 1-Tetracosene. 1-Pentatriacontene. 1-Heneicosene. 1-Octacosene. 1-Dodecene. 1-Heptadecene. 1-Pentadecene. 1-Heneicosene. 1-Dotriacontene. 1-Nonene. 1-Nonadecene. 1-Tridecene.

Find more compounds similar to 1-Octene.

Mixtures

Find more mixtures with 1-Octene.

Sources

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