Chemical Properties of Acetonitrile, bromo- (CAS 590-17-0)

Acetonitrile, bromo-

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InChI
InChI=1S/C2H2BrN/c3-1-2-4/h1H2
InChI Key
REXUYBKPWIPONM-UHFFFAOYSA-N
Formula
C2H2BrN
SMILES
N#CCBr
Molecular Weight1
119.95
CAS
590-17-0
Other Names
  • Bromoacetonitrile
  • Bromomethyl cyanide
  • Cyanomethyl bromide
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Physical Properties

Property Value Unit Source
Δf 113.46 kJ/mol Joback Calculated Property
Δfgas 106.60 kJ/mol Joback Calculated Property
Δfus 7.73 kJ/mol Joback Calculated Property
Δvap 36.96 kJ/mol Joback Calculated Property
IE 11.28 eV NIST
log10WS -0.96 Crippen Calculated Property
logPoct/wat 0.905 Crippen Calculated Property
McVol 57.920 ml/mol McGowan Calculated Property
Pc 5359.18 kPa Joback Calculated Property
Inp [725.00; 725.00]   Show Hide
Inp 725.00 NIST
Inp 725.00 NIST
Inp 725.00 NIST
Tboil 413.40 K Joback Calculated Property
Tc 629.95 K Joback Calculated Property
Tfus 237.09 K Joback Calculated Property
Vc 0.235 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [76.64; 91.67] J/mol×K [413.40; 629.95] Show Hide
Cp,gas 76.64 J/mol×K 413.40 Joback Calculated Property
Cp,gas 79.57 J/mol×K 449.49 Joback Calculated Property
Cp,gas 82.31 J/mol×K 485.58 Joback Calculated Property
Cp,gas 84.88 J/mol×K 521.67 Joback Calculated Property
Cp,gas 87.29 J/mol×K 557.76 Joback Calculated Property
Cp,gas 89.55 J/mol×K 593.86 Joback Calculated Property
Cp,gas 91.67 J/mol×K 629.95 Joback Calculated Property

Pressure Dependent Properties

Property Value Unit Pressure (kPa) Source
Tboilr 334.20 K 3.20 NIST

Similar Compounds

Acetonitrile, dibromo-. Cyanomethyl radical. Acetonitrile, bromochloro-. Acetonitrile. 1-Propyne, 3-bromo-. Chloromethyl cyanide. 1,2-Dibromoethane-d3. 1,2-dibromo-[1,1,2,2-2H4]ethane. Ethane, 1,2-dibromo-. 1,2-Dibromoethane-d2(1,2). HCCN radical. Ethyl bromide. Bromoacetyl bromide. Iodoacetonitrile. Propanedinitrile.

Find more compounds similar to Acetonitrile, bromo-.

Sources

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