Chemical Properties of 2,2,3-Trichloro-n-(4-chloro-2-nitrophenyl)propanamide (CAS 116402-47-2)

2,2,3-Trichloro-n-(4-chloro-2-nitrophenyl)propanamide

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InChI
InChI=1S/C9H6Cl4N2O3/c10-4-9(12,13)8(16)14-6-2-1-5(11)3-7(6)15(17)18/h1-3H,4H2,(H,14,16)
InChI Key
UNKOKYAXAPLGTA-UHFFFAOYSA-N
Formula
C9H6Cl4N2O3
SMILES
O=C(Nc1ccc(Cl)cc1[N+](=O)[O-])C(Cl)(Cl)CCl
Molecular Weight1
331.97
CAS
116402-47-2
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Physical Properties

Property Value Unit Source
ΔfG° 69.19 kJ/mol Joback Calculated Property
ΔfH°gas -157.08 kJ/mol Joback Calculated Property
ΔfusH° 39.76 kJ/mol Joback Calculated Property
ΔvapH° 85.24 kJ/mol Joback Calculated Property
log10WS -4.50 Crippen Calculated Property
logPoct/wat 3.599 Crippen Calculated Property
McVol 191.840 ml/mol McGowan Calculated Property
Pc 3012.33 kPa Joback Calculated Property
Tboil 844.33 K Joback Calculated Property
Tc 1109.48 K Joback Calculated Property
Tfus 610.95 K Joback Calculated Property
Vc 0.740 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [444.18; 477.06] J/mol×K [844.33; 1109.48] Show Hide
Cp,gas 444.18 J/mol×K 844.33 Joback Calculated Property
Cp,gas 451.17 J/mol×K 888.52 Joback Calculated Property
Cp,gas 457.41 J/mol×K 932.71 Joback Calculated Property
Cp,gas 463.02 J/mol×K 976.90 Joback Calculated Property
Cp,gas 468.09 J/mol×K 1021.10 Joback Calculated Property
Cp,gas 472.74 J/mol×K 1065.29 Joback Calculated Property
Cp,gas 477.06 J/mol×K 1109.48 Joback Calculated Property

Similar Compounds

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Sources

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