Chemical Properties of P-toluidine, 3,5-dinitro- (CAS 19406-51-0)

P-toluidine, 3,5-dinitro-

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InChI
InChI=1S/C7H7N3O4/c1-4-6(9(11)12)2-5(8)3-7(4)10(13)14/h2-3H,8H2,1H3
InChI Key
KQRJATLINVYHEZ-UHFFFAOYSA-N
Formula
C7H7N3O4
SMILES
Cc1c([N+](=O)[O-])cc(N)cc1[N+](=O)[O-]
Molecular Weight1
197.15
CAS
19406-51-0
Other Names
  • 2,6-Dinitro-4-aminotoluene
  • 3,5-Dinitro-4-methylaniline
  • 3,5-Dinitro-p-toluidine
  • 4-ADNT
  • 4-Amino-2,6-dinitrotoluene
  • 4-Methyl-3,5-dinitrobenzenamine
  • 4-Methyl-3,5-dinitrophenylamine
  • Benzenamine, 4-methyl-3,5-dinitro-
  • NSC 25010
Sources

Physical Properties

Property Value Unit Source
Δf 229.13 kJ/mol Joback Calculated Property
Δfgas 26.58 kJ/mol Joback Calculated Property
Δfus 34.68 kJ/mol Joback Calculated Property
Δvap 79.26 kJ/mol Joback Calculated Property
logPoct/wat 1.394 Crippen Calculated Property
Pc 4311.22 kPa Joback Calculated Property
Tboil 777.39 K Joback Calculated Property
Tc 1055.29 K Joback Calculated Property
Tfus 603.11 K Joback Calculated Property
Vc 0.512 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 345.91 J/mol×K 777.39 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
=C< (ring) 4
-NO2 2
-CH3 1
=CH- (ring) 2
-NH2 1

Similar Compounds

Trinitrotoluene. Benzenamine, 2-methyl-3,5-dinitro-. Benzene, 2-methyl-1,3-dinitro-. Benzene, 1-methyl-2,4-dinitro-. Benzenamine, 4-methyl-3-nitro-. 2-Methyl-3-nitroaniline. 2,4-Dinitro-1,3-dimethyl-benzene. Dinitromesitylene. 4,6-Dinitro-1,3-dimethyl-benzene. 2,6-Dinitrobenzonitrile. 2,4-Dinitrobenzaldehyde. Benzenamine, 2-methyl-5-nitro-. Benzene, 1,1'-(1,2-ethenediyl)bis[2,4,6-trinitro-. 2,2',4,4',6,6'-Hexanitrodibenzyl. Benzene, 1-methyl-2-nitro-.

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