Chemical Properties of «alpha»-Nitroacetophenone (CAS 614-21-1)

«alpha»-Nitroacetophenone

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InChI
InChI=1S/C8H7NO3/c10-8(6-9(11)12)7-4-2-1-3-5-7/h1-5H,6H2
InChI Key
JTWHVBNYYWFXSI-UHFFFAOYSA-N
Formula
C8H7NO3
SMILES
O=C(C[N+](=O)[O-])c1ccccc1
Molecular Weight1
165.15
CAS
614-21-1
Other Names
  • Ethanone, 2-nitro-1-phenyl-
  • Benzoylnitromethane
  • Acetophenone, 2-nitro-
  • «omega»-Nitroacetophenone
  • 2-Nitro-1-phenylethanone
  • 2-Nitroacetophenone
  • Nitromethyl phenyl ketone
  • NSC 4509
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Physical Properties

Property Value Unit Source
Δf 35.52 kJ/mol Joback Calculated Property
Δfgas -95.26 kJ/mol Joback Calculated Property
Δfus 23.48 kJ/mol Joback Calculated Property
Δvap 59.02 kJ/mol Joback Calculated Property
log10WS -2.22 Crippen Calculated Property
logPoct/wat 1.146 Crippen Calculated Property
McVol 118.810 ml/mol McGowan Calculated Property
Pc 4005.77 kPa Joback Calculated Property
Tboil 614.83 K Joback Calculated Property
Tc 865.79 K Joback Calculated Property
Tfus 399.88 K Joback Calculated Property
Vc 0.464 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [277.61; 330.85] J/mol×K [614.83; 865.79] Show Hide
Cp,gas 277.61 J/mol×K 614.83 Joback Calculated Property
Cp,gas 288.62 J/mol×K 656.66 Joback Calculated Property
Cp,gas 298.72 J/mol×K 698.48 Joback Calculated Property
Cp,gas 307.93 J/mol×K 740.31 Joback Calculated Property
Cp,gas 316.32 J/mol×K 782.14 Joback Calculated Property
Cp,gas 323.95 J/mol×K 823.96 Joback Calculated Property
Cp,gas 330.85 J/mol×K 865.79 Joback Calculated Property

Similar Compounds

Ethanone, 2-amino-1-phenyl-. Ethanone, 2-(dimethylamino)-1-phenyl-. Acetophenone. Acetophenone-«alpha»,«alpha»,«alpha»-d3. Ethanone, 2-iodo-1-phenyl-. Ethanone, 2-bromo-1-phenyl-. 2-Naphthyl methyl ketone. 2-Acetylphenanthrene. Acetophenone, 2-chloro-. Ethanone, 1,1'-(1,3-phenylene)bis-. Dibenzoylmethane. Ethanone, 2-hydroxy-1-phenyl-. Acetophenone, 3'-chloro-. Benzenepropanenitrile, «beta»-oxo-. Ethanone, 1-(1-Naphthalenyl)-.

Find more compounds similar to «alpha»-Nitroacetophenone.

Sources

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