Chemical Properties of 4,4'-Methylene di-carbanilide

4,4'-Methylene di-carbanilide

InChI
InChI=1S/C27H24N4O2/c32-26(28-22-7-3-1-4-8-22)30-24-15-11-20(12-16-24)19-21-13-17-25(18-14-21)31-27(33)29-23-9-5-2-6-10-23/h1-18H,19H2,(H2,28,30,32)(H2,29,31,33)
InChI Key
AFGPVXVFZRRJGM-UHFFFAOYSA-N
Formula
C27H24N4O2
SMILES
O=C(Nc1ccccc1)Nc1ccc(Cc2ccc(NC(=O)Nc3ccccc3)cc2)cc1
Molecular Weight1
436.51
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Physical Properties

Property Value Unit Source
ω 1.0852 Relay (1.0) Calculated Property
ΔfH°gas 62.55 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 64.67 kJ/mol Joback Calculated Property
ΔvapH° 176.20 kJ/mol Relay (1.0) Calculated Property
IE 7.53 eV Relay (1.0) Calculated Property
log10WS -6.79 Relay (1.0) Calculated Property
logPoct/wat 6.565 Crippen Calculated Property
McVol 339.310 ml/mol McGowan Calculated Property
Pc 1829.41 kPa Joback Calculated Property
Tboil 787.44 K Relay (1.0) Calculated Property
Tc 1300.54 K Relay (1.0) Calculated Property
Tfus 512.36 K Relay (1.0) Calculated Property
Vc 1.180 m3/kmol Relay (1.0) Calculated Property

Cheméo can also estimate Standard Gibbs free energy of formation for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [420.91; 1057.70] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-1.18799e+02
Coefficient B2.38300e+00
Coefficient C-1.59272e-03
Coefficient D3.86220e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 420.91 J/mol×K 273.00 Calculated Property
Cp,gas 542.01 J/mol×K 353.78 Calculated Property
Cp,gas 647.67 J/mol×K 434.56 Calculated Property
Cp,gas 739.12 J/mol×K 515.33 Calculated Property
Cp,gas 817.58 J/mol×K 596.11 Calculated Property
Cp,gas 884.26 J/mol×K 676.89 Calculated Property
Cp,gas 940.39 J/mol×K 757.67 Calculated Property
Cp,gas 987.19 J/mol×K 838.44 Calculated Property
Cp,gas 1025.89 J/mol×K 919.22 Calculated Property
Cp,gas 1057.70 J/mol×K 1000.00 Calculated Property

Similar Compounds

4,4'-Methylene-bis-(n-methylaniline). Urea, 1,1'-(methylenedi-p-phenylene)bis[3-(2-chloroethyl)-. UREA, N,N'-BIS(3-METHYLPHENYL)-. Urea, N-(2-methylphenyl)-N'-phenyl-. N,N'-[Methylenebis(2-chloro-4,1-phenylene)]bis(2,2,2-trifluoroacetamide). Carbanilide, 2,2'-dimethyl-. Benzenamine, 4,4'-methylenebis[N,N-dimethyl-. N,N'-[Methylenebis(2-chloro-4,1-phenylene)]bis(2,2,3,3,3-pentafluoropropionamide). N-(2-chloro-4-(3-chloro-4-[(trifluoroacetyl)amino]benzyl)phenyl)-N-(trifluoroacetyl)-2,2,2-trifluoroacetamide. N,N'-Di-(m-trifluoromethylphenyl)urea. N,N'-[Methylenebis(2-chloro-4,1-phenylene)]bis(2,2,3,3,4,4,4-heptafluorobutanamide). Benzenamine, 4,4'-methylenebis-. Benzenamine, 4-(phenylmethyl)-. Benzenamine, 4,4'-methylenebis[2-chloro-. N-(2-Chloro-4-(3-chloro-4-[(2,2,3,3,3-pentafluoropropanoyl)amino]benzyl)phenyl)-2,2,3,3,3-pentafluoro-N-(2,2,3,3,3-pentafluoropropanoyl)propanamide.

Find more compounds similar to 4,4'-Methylene di-carbanilide.

Sources

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