Chemical Properties of 1,3-Diamino-2,4,6-trinitrobenzene (CAS 28930-29-2)

1,3-Diamino-2,4,6-trinitrobenzene

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InChI
InChI=1S/C6H5N5O6/c7-4-2(9(12)13)1-3(10(14)15)5(8)6(4)11(16)17/h1H,7-8H2
InChI Key
FZAZPMLWYUKRAE-UHFFFAOYSA-N
Formula
C6H5N5O6
SMILES
Nc1c([N+](=O)[O-])cc([N+](=O)[O-])c(N)c1[N+](=O)[O-]
Molecular Weight1
243.13
CAS
28930-29-2
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Physical Properties

Property Value Unit Source
Δf 313.08 kJ/mol Joback Calculated Property
Δfgas 58.78 kJ/mol Joback Calculated Property
Δfus 48.26 kJ/mol Joback Calculated Property
Δsub 143.50 kJ/mol NIST
Δvap 104.93 kJ/mol Joback Calculated Property
log10WS -2.69 Crippen Calculated Property
logPoct/wat 0.576 Crippen Calculated Property
McVol 143.860 ml/mol McGowan Calculated Property
Pc 5304.68 kPa Joback Calculated Property
Tboil 983.86 K Joback Calculated Property
Tc 1282.68 K Joback Calculated Property
Tfus 831.23 K Joback Calculated Property
Vc 0.568 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [407.06; 425.51] J/mol×K [983.86; 1282.68] Show Hide
Cp,gas 407.06 J/mol×K 983.86 Joback Calculated Property
Cp,gas 412.18 J/mol×K 1033.66 Joback Calculated Property
Cp,gas 416.42 J/mol×K 1083.47 Joback Calculated Property
Cp,gas 419.82 J/mol×K 1133.27 Joback Calculated Property
Cp,gas 422.43 J/mol×K 1183.08 Joback Calculated Property
Cp,gas 424.32 J/mol×K 1232.88 Joback Calculated Property
Cp,gas 425.51 J/mol×K 1282.68 Joback Calculated Property
ΔsubH 140.00 kJ/mol 358.50 NIST

Similar Compounds

1,3-Benzenediamine, 2,4,6-trinitro-. Benzenamine, 2,4,6-trinitro-. Benzenamine, 2,4-dinitro-. Benzenamine, 2,6-dinitro-. 1,4-Benzenediamine, 2-nitro-. 4-chloro-2,6-dinitroaniline. 1,3,5-Benzenetriamine, 2,4,6-trinitro-. 2,4,6-Trinitrophenyl-hydrazine. Benzenamine, 2-chloro-4,6-dinitro-. 2,4,6-Trinitro-N-methyl-aniline. 5-Chloro-3-nitro-o-phenylene diamine. Dipicrylamine. 4-nitro-1,2-benzenediamine. o-Nitroaniline. Hydrazine, (2,4-dinitrophenyl)-.

Find more compounds similar to 1,3-Diamino-2,4,6-trinitrobenzene.

Sources

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