Chemical Properties of Benzene, 2-propenyl- (CAS 300-57-2)

Benzene, 2-propenyl-

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InChI
InChI=1S/C9H10/c1-2-6-9-7-4-3-5-8-9/h2-5,7-8H,1,6H2
InChI Key
HJWLCRVIBGQPNF-UHFFFAOYSA-N
Formula
C9H10
SMILES
C=CCc1ccccc1
Molecular Weight1
118.18
CAS
300-57-2
Other Names
  • 1-Phenyl-2-propene
  • 1-Propene, 3-phenyl-
  • 2-Propenylbenzene
  • 3-Phenyl-1-propene
  • 3-Phenylpropene
  • Allylbenzene
  • Benzene, allyl-
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Physical Properties

Property Value Unit Source
Δcliquid -5169.30 kJ/mol NIST
Δf 225.15 kJ/mol Joback Calculated Property
Δfgas 132.87 kJ/mol Joback Calculated Property
Δfus 11.83 kJ/mol Joback Calculated Property
Δvap 46.30 ± 0.20 kJ/mol NIST
IE [7.80; 9.16] eV Show Hide
IE 8.70 eV NIST
IE 7.80 ± 0.10 eV NIST
IE 8.60 eV NIST
IE 8.20 ± 0.02 eV NIST
IE 9.16 eV NIST
log10WS -2.55 Crippen Calculated Property
logPoct/wat 2.415 Crippen Calculated Property
McVol 109.610 ml/mol McGowan Calculated Property
Pc 3423.86 kPa Joback Calculated Property
Inp [143.10; 953.00]   Show Hide
Inp 914.00 NIST
Inp 927.00 NIST
Inp 927.00 NIST
Inp 939.00 NIST
Inp 922.00 NIST
Inp 919.00 NIST
Inp 932.60 NIST
Inp 948.00 NIST
Inp 934.00 NIST
Inp 917.80 NIST
Inp 920.00 NIST
Inp 938.90 NIST
Inp 943.60 NIST
Inp 950.50 NIST
Inp 917.80 NIST
Inp 920.00 NIST
Inp 929.30 NIST
Inp 929.30 NIST
Inp 929.30 NIST
Inp 953.00 NIST
Inp 950.00 NIST
Inp 947.00 NIST
Inp 951.50 NIST
Inp 928.00 NIST
Inp 934.40 NIST
Inp 934.40 NIST
Inp 934.00 NIST
Inp 933.00 NIST
Inp 930.00 NIST
Inp 930.00 NIST
Inp 928.00 NIST
Inp 929.00 NIST
Inp Outlier 154.50 NIST
Inp Outlier 143.10 NIST
I [1240.00; 1291.10]   Show Hide
I 1263.20 NIST
I 1291.10 NIST
I 1240.00 NIST
I 1240.00 NIST
I 1263.00 NIST
Tboil 428.68 K Joback Calculated Property
Tc 640.52 K Joback Calculated Property
Tfus 233.15 ± 4.00 K NIST
Vc 0.412 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [198.96; 267.72] J/mol×K [428.68; 640.52] Show Hide
Cp,gas 198.96 J/mol×K 428.68 Joback Calculated Property
Cp,gas 212.33 J/mol×K 463.99 Joback Calculated Property
Cp,gas 224.89 J/mol×K 499.29 Joback Calculated Property
Cp,gas 236.67 J/mol×K 534.60 Joback Calculated Property
Cp,gas 247.71 J/mol×K 569.90 Joback Calculated Property
Cp,gas 258.05 J/mol×K 605.21 Joback Calculated Property
Cp,gas 267.72 J/mol×K 640.52 Joback Calculated Property
η [0.0002292; 0.0030563] Pa×s [215.85; 428.68] Show Hide
η 0.0030563 Pa×s 215.85 Joback Calculated Property
η 0.0014635 Pa×s 251.32 Joback Calculated Property
η 0.0008408 Pa×s 286.79 Joback Calculated Property
η 0.0005458 Pa×s 322.26 Joback Calculated Property
η 0.0003859 Pa×s 357.74 Joback Calculated Property
η 0.0002905 Pa×s 393.21 Joback Calculated Property
η 0.0002292 Pa×s 428.68 Joback Calculated Property
ΔvapH 46.50 ± 0.20 kJ/mol 293.50 NIST

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.64] kPa [315.16; 457.39] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.43101e+01
Coefficient B-3.57239e+03
Coefficient C-6.03980e+01
Temperature range, min.315.16
Temperature range, max.457.39
Pvap 1.33 kPa 315.16 Calculated Property
Pvap 3.02 kPa 330.96 Calculated Property
Pvap 6.27 kPa 346.77 Calculated Property
Pvap 12.03 kPa 362.57 Calculated Property
Pvap 21.66 kPa 378.37 Calculated Property
Pvap 36.86 kPa 394.18 Calculated Property
Pvap 59.80 kPa 409.98 Calculated Property
Pvap 93.04 kPa 425.78 Calculated Property
Pvap 139.54 kPa 441.59 Calculated Property
Pvap 202.64 kPa 457.39 Calculated Property

Similar Compounds

Benzene, 1-methyl-4-(2-propenyl)-. Benzene, (3-chloroallyl)-. 1-methyl-3-allylbenzene. Benzene, 2-butenyl-, trans. Benzene, 2-butenyl-. Benzene, 2-butenyl-, cis. Benzene, 1,1'-(2-butene-1,4-diyl)bis-. 1-Phenyl-2,4-pentadiyne. Naphthalene, 1-(2-propenyl)-. Phenol, 4-(2-propenyl)-. 4-phenyl-2-buten-1-al. Benzene, 1-methyl-2-(2-propenyl)-. Hexa-2,4-dienylbenzene. Estragole. Benzene, (3-methyl-2-butenyl)-.

Find more compounds similar to Benzene, 2-propenyl-.

Mixtures

Sources

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