Chemical Properties of Acetamide, N-(3-nitrophenyl)- (CAS 122-28-1)

Acetamide, N-(3-nitrophenyl)-

InChI
InChI=1S/C8H8N2O3/c1-6(11)9-7-3-2-4-8(5-7)10(12)13/h2-5H,1H3,(H,9,11)
InChI Key
KFTYNYHJHKCRKU-UHFFFAOYSA-N
Formula
C8H8N2O3
SMILES
CC(=O)Nc1cccc([N+](=O)[O-])c1
Molecular Weight1
180.16
CAS
122-28-1
Other Names
  • Acetanilide, 3'-nitro-
  • m-Nitroacetanilide
  • N-(3-Nitrophenyl)acetamide
  • N-Acetyl-m-nitroaniline
  • 3-Nitro-N-acetylaniline
  • 3'-Nitroacetanilide
  • 3-Nitroacetanilide
  • N-(3-Nitrophenyl)acetic acid amide
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Physical Properties

Property Value Unit Source
ΔfH°gas -135.45 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 28.19 kJ/mol Joback Calculated Property
ΔvapH° 85.02 kJ/mol Relay (1.0) Calculated Property
IE 8.80 ± 0.20 eV NIST
log10WS -2.31 Relay (1.0) Calculated Property
logPoct/wat 1.553 Crippen Calculated Property
McVol 128.790 ml/mol McGowan Calculated Property
Tboil 562.34 K Relay (1.0) Calculated Property
Tfus 427.70 ± 0.50 K NIST

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [164.77; 382.63] 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-1.23500e+01
Coefficient B7.72980e-01
Coefficient C-4.83860e-04
Coefficient D1.05860e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 164.77 J/mol×K 273.00 Calculated Property
Cp,gas 205.24 J/mol×K 353.78 Calculated Property
Cp,gas 240.87 J/mol×K 434.56 Calculated Property
Cp,gas 271.98 J/mol×K 515.33 Calculated Property
Cp,gas 298.92 J/mol×K 596.11 Calculated Property
Cp,gas 322.01 J/mol×K 676.89 Calculated Property
Cp,gas 341.59 J/mol×K 757.67 Calculated Property
Cp,gas 358.00 J/mol×K 838.44 Calculated Property
Cp,gas 371.57 J/mol×K 919.22 Calculated Property
Cp,gas 382.63 J/mol×K 1000.00 Calculated Property

Similar Compounds

Acetamide, N-(3-nitrophenyl)-2-chloro-. Acetamide, N-(3-nitrophenyl)-2,2,2-trifluoro-. Acetamide, N-(3-nitrophenyl)-2,2-dichloro-. Acetamide, N-(3-nitrophenyl)-2-methoxy-. Propanamide, N-(3-nitrophenyl)-2-methyl-. Propanamide, 2,2-dimethyl-N-(3-nitrophenyl)-. Acetamide, N-(3-nitrophenyl)-2-acetoxy-. Butanamide, N-(3-nitrophenyl)-. Propanamide, N-(3-nitrophenyl)-2,2,3,3,3-pentafluoro-. Propanamide, N-(3-nitrophenyl)-2-chloro-. Acetamide, N-(2-nitrophenyl)-. Acetamide, N-(4-nitrophenyl)-. 2',4'-Dinitroacetanilide. 2-Amino-4-nitrophenol, N-acetyl-. AMINOFORMIC ACID, N-[3-NITROPHENYL]-, ETHYL(ESTER).

Find more compounds similar to Acetamide, N-(3-nitrophenyl)-.

Sources

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