Chemical Properties of Acetamide, N-(2-nitrophenyl)- (CAS 552-32-9)

Acetamide, N-(2-nitrophenyl)-

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InChI
InChI=1S/C8H8N2O3/c1-6(11)9-7-4-2-3-5-8(7)10(12)13/h2-5H,1H3,(H,9,11)
InChI Key
BUNFNRVLMKHKIT-UHFFFAOYSA-N
Formula
C8H8N2O3
SMILES
CC(=O)Nc1ccccc1[N+](=O)[O-]
Molecular Weight1
180.16
CAS
552-32-9
Other Names
  • 2'-Nitroacetanilide
  • 2-Nitroacetanilide
  • Acetanilide, 2'-nitro-
  • o-Nitroacetanilide
Sources

Physical Properties

Property Value Unit Source
Δf 115.28 kJ/mol Joback Calculated Property
Δfgas -53.26 kJ/mol Joback Calculated Property
Δfus 28.19 kJ/mol Joback Calculated Property
Δvap 66.11 kJ/mol Joback Calculated Property
IE 8.85 eV NIST
logPoct/wat 1.55 Crippen Calculated Property
Pc 3995.65 kPa Joback Calculated Property
Tboil 669.98 K Joback Calculated Property
Tc 918.65 K Joback Calculated Property
Tfus 366.20 ± 0.50 K NIST
Vc 0.50 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 320.18 J/mol×K 669.98 Joback Calculated Property
ΔvapH 44.00 kJ/mol 533.0 NIST

Molecular Descriptors

Joback and Reid Groups
>C=O (nonring) 1
=CH- (ring) 4
-NO2 1
=C< (ring) 2
>NH 1
-CH3 1

Similar Compounds

2,4-Dinitro acetanilide. 4'-Bromo-2'-nitroacetanilide. 4'-Fluoro-2'-nitroacetanilide. Acetamide, n-(4-methoxy-2-nitrophenyl)-. Benzenamine, N-methyl-2-nitro-. 4-Ethoxy-2-nitro acetanilide. O-nitro carbanilic acid, methyl ester. 2,4-Difluoro-6-nitroacetanilide. O-nitro carbanilic acid, ethyl ester. 2',4'-Dinitro-5'-fluoroacetanilide. Benzenamine, N-methyl-2,4-dinitro-. O-nitro carbanilic acid, n-pentyl ester. 2,2,3-Trichloro-n-(4-chloro-2-nitrophenyl)propanamide. O-nitro carbanilic acid, n-hexyl ester. O-nitro carbanilic acid, phenethyl ester.

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