Chemical Properties of Benzene, (2-nitroethenyl)-

Benzene, (2-nitroethenyl)-

InChI
InChI=1S/C8H7NO2/c10-9(11)7-6-8-4-2-1-3-5-8/h1-7H
InChI Key
PIAOLBVUVDXHHL-UHFFFAOYSA-N
Formula
C8H7NO2
SMILES
O=[N+]([O-])C=Cc1ccccc1
Molecular Weight1
149.15
Other Names
  • (2-Nitrovinyl)benzene
  • 1-Nitro-2-phenylethylene
  • 1-Phenyl-2-nitroethene
  • 2-Nitro-1-phenylethylene
  • 2-Nitroethenylbenzene
  • BNS
  • NCI-C02211
  • NSC 9809
  • Styrene, beta-nitro
  • Styrene, «beta»-nitro-
  • «beta»-Nitrostyrene
  • «omega»-Nitrostyrene
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Physical Properties

Property Value Unit Source
ω 0.4269 Relay (1.0) Calculated Property
ΔcH°solid -4179.00 ± 2.10 kJ/mol NIST
ΔfG° 244.66 kJ/mol Joback Calculated Property
ΔfH°gas 121.03 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 22.08 kJ/mol Joback Calculated Property
ΔvapH° 64.37 kJ/mol Relay (1.0) Calculated Property
IE 9.00 eV Relay (1.0) Calculated Property
log10WS -2.57 Relay (1.0) Calculated Property
logPoct/wat 1.934 Crippen Calculated Property
McVol 112.940 ml/mol McGowan Calculated Property
Pc 3950.57 kPa Joback Calculated Property
Tboil 533.20 K Relay (1.0) Calculated Property
Tc 762.15 K Relay (1.0) Calculated Property
Tfus [331.00; 331.15] K Show Hide
Tfus 331.15 K Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) Compiled value
Tfus 331.00 ± 4.00 K NIST

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [131.10; 329.18] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-4.69800e+01
Coefficient B8.04260e-01
Coefficient C-6.04800e-04
Coefficient D1.76700e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 131.10 J/mol×K 273.00 Calculated Property
Cp,gas 169.68 J/mol×K 353.78 Calculated Property
Cp,gas 202.81 J/mol×K 434.56 Calculated Property
Cp,gas 231.05 J/mol×K 515.33 Calculated Property
Cp,gas 254.96 J/mol×K 596.11 Calculated Property
Cp,gas 275.11 J/mol×K 676.89 Calculated Property
Cp,gas 292.05 J/mol×K 757.67 Calculated Property
Cp,gas 306.33 J/mol×K 838.44 Calculated Property
Cp,gas 318.52 J/mol×K 919.22 Calculated Property
Cp,gas 329.18 J/mol×K 1000.00 Calculated Property

Similar Compounds

Styrene, «beta»-nitro-, (E)-. [(Z)-2-nitroethenyl]benzene. 4-Methoxy-.beta.-nitrostyrene. p,«beta»-Dinitrostyrene. Anisole, m-(2-nitrovinyl)-. 2,4-Dichloro-.omega.-nitrostyrene. Styrene. Benzene, (2-nitro-1-propenyl)-. Anthracene, 9-(2-nitroethenyl)-. m-(2-Nitrovinyl)nitrobenzene. (E)-Stilbene. cis-Stilbene. Stilbene. Benzene, 1-methoxy-2-(2-nitroethenyl)-. Naphthalene, 2-ethenyl-.

Find more compounds similar to Benzene, (2-nitroethenyl)-.

Sources

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Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
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