Chemical Properties of Benzonitrile, 4-(bromoacetyl)- (CAS 20099-89-2)

Benzonitrile, 4-(bromoacetyl)-

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InChI
InChI=1S/C9H6BrNO/c10-5-9(12)8-3-1-7(6-11)2-4-8/h1-4H,5H2
InChI Key
LJANCPRIUMHGJE-UHFFFAOYSA-N
Formula
C9H6BrNO
SMILES
N#Cc1ccc(C(=O)CBr)cc1
Molecular Weight1
224.05
CAS
20099-89-2
Other Names
  • 4-Cyanophenacyl bromide
  • p-Bromoacetylbenzonitrile
  • Benzonitrile, 4-(2-bromoacetyl)-
  • 4-(2-Bromoacety)-BenZonitrile

Physical Properties

Property Value Unit Source
Δf 146.26 kJ/mol Joback Calculated Property
Δfgas 74.60 kJ/mol Joback Calculated Property
Δfus 21.11 kJ/mol Joback Calculated Property
Δvap 62.23 kJ/mol Joback Calculated Property
IE 9.90 eV NIST
log10WS -2.92 Crippen Calculated Property
logPoct/wat 2.136 Crippen Calculated Property
McVol 134.360 ml/mol McGowan Calculated Property
Pc 3633.35 kPa Joback Calculated Property
Tboil 659.09 K Joback Calculated Property
Tc 907.81 K Joback Calculated Property
Tfus 404.85 K Joback Calculated Property
Vc 0.525 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [283.01; 325.72] J/mol×K [659.09; 907.81] Show Hide
Cp,gas 283.01 J/mol×K 659.09 Joback Calculated Property
Cp,gas 291.76 J/mol×K 700.54 Joback Calculated Property
Cp,gas 299.80 J/mol×K 742.00 Joback Calculated Property
Cp,gas 307.16 J/mol×K 783.45 Joback Calculated Property
Cp,gas 313.90 J/mol×K 824.90 Joback Calculated Property
Cp,gas 320.07 J/mol×K 866.35 Joback Calculated Property
Cp,gas 325.72 J/mol×K 907.81 Joback Calculated Property

Similar Compounds

Benzonitrile, 4-acetyl-. Ethanone, 2-bromo-1-phenyl-. Ethanone, 2-bromo-1-(4-methylphenyl)-. Ethanone, 1,1'-(1,4-phenylene)bis-. Bromo-4-fluoroacetophenone. Acetophenone, 4-trifluoroacetyl. 4'-(Trifluoromethyl)acetophenone. 3-Acetylbenzonitrile. Acetophenone. Acetophenone-«alpha»,«alpha»,«alpha»-d3. Ethanone, 1-(4-methylphenyl)-. Ethanone, 1-[4-(1,1-dimethylethyl)phenyl]-. 4-Acetylbenzoic acid. Ethanone, 2-bromo-1-(3-bromophenyl)-. Ethanone, 2-bromo-1-(4-methoxyphenyl)-.

Find more compounds similar to Benzonitrile, 4-(bromoacetyl)-.

Sources

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