Chemical Properties of 1,7-Diacetoxy-2,4,6-trinitro-2,4,6-triazaheptane (CAS 14173-62-7)

1,7-Diacetoxy-2,4,6-trinitro-2,4,6-triazaheptane

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InChI
InChI=1S/C8H14N6O10/c1-7(15)23-5-10(13(19)20)3-9(12(17)18)4-11(14(21)22)6-24-8(2)16/h3-6H2,1-2H3
InChI Key
CHBKPOAEXQUKHL-UHFFFAOYSA-N
Formula
C8H14N6O10
SMILES
CC(=O)OCN(CN(CN(COC(C)=O)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]
Molecular Weight1
354.23
CAS
14173-62-7
Other Names
  • 1,7-Diacetoxy-2,4,6-trinitro-2,4,6-triazaheptane
Sources

Physical Properties

Property Value Unit Source
Δf -12.37 kJ/mol Joback Calculated Property
Δfgas -527.74 kJ/mol Joback Calculated Property
Δfus 65.20 kJ/mol Joback Calculated Property
Δvap 107.62 kJ/mol Joback Calculated Property
logPoct/wat -1.58 Crippen Calculated Property
Pc 2878.12 kPa Joback Calculated Property
Tboil 1027.86 K Joback Calculated Property
Tc 1270.24 K Joback Calculated Property
Tfus 422.50 ± 0.50 K NIST
Vc 0.83 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 704.77 J/mol×K 1027.86 Joback Calculated Property
ΔfusH 38.49 kJ/mol 422.5 NIST
ΔfusH 38.49 kJ/mol 422.5 NIST

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
>C=O (nonring) 2
-NO2 3
-CH2- 4
>N- 3
-CH3 2

Similar Compounds

1,3,5-Triazine, hexahydro-1,3,5-trinitro-. 1-Nitroso-3,5-dinitro-hexahydro-1,3,5-triazine. Cyclotetramethylenetetranitramine. N,N',N"-Trinitro-1,3,5-triazacycloheptane. Methanediamine, N,N'-dimethyl-N,N'-dinitro-. N,N'-Dimethyl-N,N'-dinitrourea. Benzquinamide M (N-des-Et), acetylated. (2-Hydroxy-3-phenyl-1,2-dihydroquinoxalin-1-yl)phenyl(3-phenyl-1-benzyl-1,2-dihydroquinoxalin-2-yl)methane. 1,3-Dinitro-2-imidazolidinone. Suxibuzone. 15-.beta.-Hydroxy-GA3, MeTMSi. Iso-GA3, MeTMSi. [13C]GA3 methyl ester TMS ether. iso[14C] GA3 methyl ester TMS ether. 3-Epi-GA, MeTMS.

Find more compounds similar to 1,7-Diacetoxy-2,4,6-trinitro-2,4,6-triazaheptane.

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