Chemical Properties of 3-Hexene, (E)- (CAS 13269-52-8)

3-Hexene, (E)-

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InChI
InChI=1S/C6H12/c1-3-5-6-4-2/h5-6H,3-4H2,1-2H3/b6-5+
InChI Key
ZQDPJFUHLCOCRG-AATRIKPKSA-N
Formula
C6H12
SMILES
CCC=CCC
Molecular Weight1
84.16
CAS
13269-52-8
Other Names
  • (E)-3-C6H12
  • (E)-3-HEXENE
  • TRANS-3-HEXENE
  • trans-hex-3-ene
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Physical Properties

Property Value Unit Source
ω 0.2270 KDB
AP 300.150 K KDB
μ 0.00 debye KDB
Δf 77.67 kJ/mol KDB
Δc,grossH 3990.07 kJ/mol KDB
Δc,netH 3725.978 kJ/mol KDB
Δfgas [-57.40; -49.30] kJ/mol Show Hide
Δfgas -54.47 kJ/mol KDB
Δfgas -49.30 ± 1.00 kJ/mol NIST
Δfgas -49.30 ± 1.10 kJ/mol NIST
Δfgas -51.50 kJ/mol NIST
Δfgas -50.60 ± 0.80 kJ/mol NIST
Δfgas -57.40 ± 1.80 kJ/mol NIST
Δfliquid [-88.90; -80.80] kJ/mol Show Hide
Δfliquid -80.80 ± 1.00 kJ/mol NIST
Δfliquid -80.80 ± 1.10 kJ/mol NIST
Δfliquid -82.13 ± 0.84 kJ/mol NIST
Δfliquid -88.90 ± 1.80 kJ/mol NIST
Δfus 11.50 kJ/mol Joback Calculated Property
Δvap [31.50; 31.60] kJ/mol Show Hide
Δvap 31.60 kJ/mol NIST
Δvap 31.50 kJ/mol NIST
Δvap 31.50 kJ/mol NIST
IE [8.83; 9.14] eV Show Hide
IE 8.83 ± 0.02 eV NIST
IE 8.97 eV NIST
IE 8.96 ± 0.01 eV NIST
IE 8.95 ± 0.01 eV NIST
IE 9.14 ± 0.01 eV NIST
log10WS -2.19 Crippen Calculated Property
logPoct/wat 2.363 Crippen Calculated Property
McVol 91.100 ml/mol McGowan Calculated Property
Pc 3250.00 kPa KDB
Inp [590.60; 606.90]   Show Hide
Inp 603.20 NIST
Inp 592.10 NIST
Inp 591.00 NIST
Inp 601.00 NIST
Inp 601.00 NIST
Inp 600.00 NIST
Inp 602.80 NIST
Inp 602.40 NIST
Inp 592.50 NIST
Inp 591.90 NIST
Inp 602.00 NIST
Inp 602.00 NIST
Inp 602.00 NIST
Inp 601.00 NIST
Inp 601.00 NIST
Inp 601.00 NIST
Inp 600.00 NIST
Inp 600.00 NIST
Inp 606.90 NIST
Inp 606.60 NIST
Inp 606.30 NIST
Inp 605.90 NIST
Inp 605.50 NIST
Inp 605.20 NIST
Inp 602.30 NIST
Inp 602.30 NIST
Inp 602.20 NIST
Inp 602.20 NIST
Inp 602.30 NIST
Inp 602.20 NIST
Inp 604.00 NIST
Inp 603.20 NIST
Inp 602.00 NIST
Inp 601.00 NIST
Inp 599.70 NIST
Inp 598.60 NIST
Inp 592.10 NIST
Inp 591.70 NIST
Inp 592.40 NIST
Inp 591.80 NIST
Inp 592.00 NIST
Inp 592.00 NIST
Inp 592.20 NIST
Inp 592.00 NIST
Inp 592.00 NIST
Inp 592.27 NIST
Inp 591.00 NIST
Inp 591.00 NIST
Inp 591.00 NIST
Inp 595.80 NIST
Inp 592.70 NIST
Inp 593.00 NIST
Inp 590.60 NIST
Inp 591.40 NIST
Inp 595.00 NIST
Inp 594.00 NIST
Inp 593.00 NIST
Inp 593.00 NIST
Inp 592.00 NIST
Inp 593.00 NIST
Inp 602.00 NIST
Inp 595.00 NIST
Inp 603.00 NIST
Inp 604.00 NIST
Inp 603.20 NIST
Inp 604.00 NIST
Inp 601.03 NIST
Inp 601.42 NIST
Inp 601.00 NIST
Inp 592.20 NIST
Inp 592.00 NIST
Inp 596.00 NIST
Inp 592.00 NIST
Inp 593.00 NIST
Inp 603.00 NIST
Inp 601.00 NIST
Inp 602.00 NIST
Inp 602.00 NIST
Inp 602.00 NIST
Inp 591.00 NIST
Inp 603.00 NIST
Inp 603.00 NIST
Inp 603.00 NIST
Inp 604.00 NIST
Inp 604.00 NIST
Inp 597.00 NIST
Inp 600.00 NIST
Inp 593.00 NIST
Inp 603.20 NIST
Inp 600.00 NIST
Inp 602.00 NIST
Inp 601.00 NIST
Inp 606.30 NIST
Inp 602.30 NIST
Inp 604.00 NIST
Inp 598.60 NIST
Inp 592.00 NIST
Inp 592.27 NIST
Inp 592.70 NIST
Inp 594.00 NIST
Inp 603.00 NIST
I [633.00; 656.40]   Show Hide
I 656.00 NIST
I 656.00 NIST
I 656.40 NIST
I 655.60 NIST
I 655.60 NIST
I 656.40 NIST
I 643.00 NIST
I Outlier 633.00 NIST
I 640.00 NIST
Tboil 340.30 K KDB
Tc [507.40; 519.90] K Show Hide
Tc 519.90 K KDB
Tc 507.40 K Gas-Liq...
Tfus [158.87; 160.15] K Show Hide
Tfus 159.70 K KDB
Tfus 159.72 ± 0.03 K NIST
Tfus Outlier 158.87 ± 0.20 K NIST
Tfus 159.49 ± 0.60 K NIST
Tfus 159.72 ± 0.20 K NIST
Tfus 159.64 ± 0.30 K NIST
Tfus 159.64 ± 0.30 K NIST
Tfus 159.48 ± 0.30 K NIST
Tfus 160.00 ± 2.00 K NIST
Tfus 160.15 ± 1.50 K NIST
Vc 0.350 m3/kmol KDB
Zc 0.2631450 KDB

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [145.03; 200.78] J/mol×K [340.84; 513.19] Show Hide
Cp,gas 145.03 J/mol×K 340.84 Joback Calculated Property
Cp,gas 155.37 J/mol×K 369.56 Joback Calculated Property
Cp,gas 165.27 J/mol×K 398.29 Joback Calculated Property
Cp,gas 174.75 J/mol×K 427.01 Joback Calculated Property
Cp,gas 183.82 J/mol×K 455.74 Joback Calculated Property
Cp,gas 192.49 J/mol×K 484.46 Joback Calculated Property
Cp,gas 200.78 J/mol×K 513.19 Joback Calculated Property
η [0.0001858; 0.0040974] Pa×s [152.30; 340.84] Show Hide
η 0.0040974 Pa×s 152.30 Joback Calculated Property
η 0.0015745 Pa×s 183.72 Joback Calculated Property
η 0.0008000 Pa×s 215.15 Joback Calculated Property
η 0.0004831 Pa×s 246.57 Joback Calculated Property
η 0.0003269 Pa×s 277.99 Joback Calculated Property
η 0.0002395 Pa×s 309.42 Joback Calculated Property
η 0.0001858 Pa×s 340.84 Joback Calculated Property
ΔvapH [28.95; 32.30] kJ/mol [309.50; 340.30] Show Hide
ΔvapH 32.30 kJ/mol 309.50 NIST
ΔvapH 28.95 kJ/mol 340.30 KDB
n0 1.39137 298.15 KDB
ρl 677.00 kg/m3 293.00 KDB
γ 0.02 N/m 298.20 KDB

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.66] kPa [246.29; 363.69] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.42386e+01
Coefficient B-2.91031e+03
Coefficient C-3.76810e+01
Temperature range, min.246.29
Temperature range, max.363.69
Pvap 1.33 kPa 246.29 Calculated Property
Pvap 3.03 kPa 259.33 Calculated Property
Pvap 6.29 kPa 272.38 Calculated Property
Pvap 12.08 kPa 285.42 Calculated Property
Pvap 21.73 kPa 298.47 Calculated Property
Pvap 36.98 kPa 311.51 Calculated Property
Pvap 59.96 kPa 324.56 Calculated Property
Pvap 93.22 kPa 337.60 Calculated Property
Pvap 139.69 kPa 350.65 Calculated Property
Pvap 202.66 kPa 363.69 Calculated Property
Pvap [6.77e-05; 3207.85] kPa [159.73; 509.00] KDB Vap... Show Hide
Equationln(Pvp) = A + B/T + C*ln(T) + D*T^2
Coefficient A7.23944e+01
Coefficient B-6.06494e+03
Coefficient C-8.71458e+00
Coefficient D7.36277e-06
Temperature range, min.159.73
Temperature range, max.509.00
Pvap 6.77e-05 kPa 159.73 Calculated Property
Pvap 0.02 kPa 198.54 Calculated Property
Pvap 0.66 kPa 237.35 Calculated Property
Pvap 7.46 kPa 276.15 Calculated Property
Pvap 42.03 kPa 314.96 Calculated Property
Pvap 152.82 kPa 353.77 Calculated Property
Pvap 415.79 kPa 392.58 Calculated Property
Pvap 928.83 kPa 431.38 Calculated Property
Pvap 1810.29 kPa 470.19 Calculated Property
Pvap 3207.85 kPa 509.00 Calculated Property

Similar Compounds

3-Hexene. 3-Hexene, (Z)-. 2-Pentene, (Z)-. 2-Pentene. 2-Pentene, (E)-. Pent-3-en-1-yl radical. n-heneicosa-3,6,9,12,15,18-hexaene. cis-3,6,9,12,15,18-heneicosahexaene. trans-3,trans-6-nonadiene. cis-3,cis-6-nonadiene. trans-3,cis-6-nonadiene. cis-2,cis-5-octadiene. 2,5-Octadiene. trans-2,cis-5-octadiene. trans-2,trans-5-octadiene.

Find more compounds similar to 3-Hexene, (E)-.

Sources

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

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