Chemical Properties of Propanediamide (CAS 108-13-4)

Propanediamide

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InChI
InChI=1S/C3H6N2O2/c4-2(6)1-3(5)7/h1H2,(H2,4,6)(H2,5,7)
InChI Key
WRIRWRKPLXCTFD-UHFFFAOYSA-N
Formula
C3H6N2O2
SMILES
NC(=O)CC(N)=O
Molecular Weight1
102.09
CAS
108-13-4
Other Names
  • 1,3-propanedioic acid, diamide
  • Carboxamidoacetamide
  • Malondiamide
  • Malonyldiamide
  • malonamide
  • malonic acid diamide
  • malonodiamide

Physical Properties

Property Value Unit Source
Δcsolid [-1495.21; -1491.90] kJ/mol Show Hide
Δcsolid -1495.21 ± 0.26 kJ/mol NIST
Δcsolid -1491.90 ± 1.50 kJ/mol NIST
Δf -150.56 kJ/mol Joback Calculated Property
Δfgas -416.40 ± 0.40 kJ/mol NIST
Δfsolid [-546.10; -542.81] kJ/mol Show Hide
Δfsolid -542.81 ± 0.53 kJ/mol NIST
Δfsolid -546.10 ± 1.50 kJ/mol NIST
Δfus [1.89; 29.85] kJ/mol Show Hide
Δfus 29.85 kJ/mol Odd eve...
Δfus 1.89 kJ/mol Odd eve...
Δfus 23.22 kJ/mol Reconci...
Δsub 126.40 ± 0.50 kJ/mol NIST
Δvap 57.05 kJ/mol Joback Calculated Property
log10WS 0.50 Crippen Calculated Property
logPoct/wat -1.653 Crippen Calculated Property
McVol 76.230 ml/mol McGowan Calculated Property
Pc 6239.25 kPa Joback Calculated Property
Inp 1125.00 NIST
Tboil 520.84 K Joback Calculated Property
Tc 742.06 K Joback Calculated Property
Tfus [443.15; 444.19] K Show Hide
Tfus 444.19 K Odd eve...
Tfus 443.15 K Reconci...
Ttriple 418.89 K Odd eve...
Vc 0.274 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [166.39; 200.13] J/mol×K [520.84; 742.06] Show Hide
Cp,gas 166.39 J/mol×K 520.84 Joback Calculated Property
Cp,gas 172.95 J/mol×K 557.71 Joback Calculated Property
Cp,gas 179.12 J/mol×K 594.58 Joback Calculated Property
Cp,gas 184.91 J/mol×K 631.45 Joback Calculated Property
Cp,gas 190.34 J/mol×K 668.32 Joback Calculated Property
Cp,gas 195.41 J/mol×K 705.19 Joback Calculated Property
Cp,gas 200.13 J/mol×K 742.06 Joback Calculated Property
Cp,solid 124.00 J/mol×K 298.15 NIST
ΔfusH [1.90; 35.80] kJ/mol [393.00; 444.20] Show Hide
ΔfusH 1.90 kJ/mol 393.00 NIST
ΔfusH 35.80 kJ/mol 443.00 NIST
ΔfusH 35.80 kJ/mol 443.00 NIST
ΔfusH 29.85 kJ/mol 444.20 NIST
ΔsubH 126.40 kJ/mol 298.15 NIST
ΔfusS [4.83; 80.81] J/mol×K [393.00; 443.00] Show Hide
ΔfusS 4.83 J/mol×K 393.00 NIST
ΔfusS 80.81 J/mol×K 443.00 NIST
ΔsubS 423.90 J/mol×K 298.15 NIST

Similar Compounds

Acetamide, 2-cyano-. Propanamide. 2-Methylmalonodiamide. Malonic acid, dihydrazide. 3-Chloropropionamide. Barbituric acid, 2-thio-. Barbituric acid. Butanediamide. Acetamide. Butanamide. Iodoacetamide. 2-Chloropropionamide. 2-Bromoacetamide. Butanamide, 3-methyl-. Propanamide, 2-methyl-.

Find more compounds similar to Propanediamide.

Sources

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