Chemical Properties of Propane, 1-isocyanato- (CAS 110-78-1)

Propane, 1-isocyanato-

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InChI
InChI=1S/C4H7NO/c1-2-3-5-4-6/h2-3H2,1H3
InChI Key
OQURWGJAWSLGQG-UHFFFAOYSA-N
Formula
C4H7NO
SMILES
CCCN=C=O
Molecular Weight1
85.10
CAS
110-78-1
Other Names
  • 1-Isocyanatopropane
  • 1-Propyl isocyanate
  • Isocyanic acid n-propyl ester
  • Isocyanic acid, propyl ester
  • Propyl isocyanate
  • UN 2482
  • n-Propyl isocyanate
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Physical Properties

Property Value Unit Source
Δfgas -131.30 kJ/mol Joback Calculated Property
Δvap 34.03 kJ/mol Joback Calculated Property
log10WS -4.99 Crippen Calculated Property
logPoct/wat 0.732 Crippen Calculated Property
McVol 74.470 ml/mol McGowan Calculated Property
Pc 4283.05 kPa Joback Calculated Property
Tboil 357.59 K Joback Calculated Property
Tc 536.84 K Joback Calculated Property

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.63] kPa [268.32; 395.00] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.43542e+01
Coefficient B-3.20748e+03
Coefficient C-4.02990e+01
Temperature range, min.268.32
Temperature range, max.395.00
Pvap 1.33 kPa 268.32 Calculated Property
Pvap 3.02 kPa 282.40 Calculated Property
Pvap 6.25 kPa 296.47 Calculated Property
Pvap 12.01 kPa 310.55 Calculated Property
Pvap 21.61 kPa 324.62 Calculated Property
Pvap 36.79 kPa 338.70 Calculated Property
Pvap 59.70 kPa 352.77 Calculated Property
Pvap 92.93 kPa 366.85 Calculated Property
Pvap 139.45 kPa 380.92 Calculated Property
Pvap 202.63 kPa 395.00 Calculated Property

Similar Compounds

Propane, 1-isothiocyanato-. Dipropyl carbodiimide. Propane, 1-isocyanato-2-methyl-. Butane, 1-isocyanato-. 1,3-Propane diisothiocyanate. Tetramethylene diisocyanate. 3-Chloropropyl isothiocyanate. Hexane, 1-isocyanato-. Propane, 1-isocyano-. n-Heptyl isocyanate. Dodecane, 1-isocyanato-. Octane, 1-isocyanato-. Octadecane, 1-isocyanato-. 3-Bromopropyl isothiocyanate. Butane, 1-isothiocyanato-.

Find more compounds similar to Propane, 1-isocyanato-.

Sources

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