Chemical Properties of 1,2,4,5-Tetroxane, 3,3,6,6-tetramethyl- (CAS 1073-91-2)

1,2,4,5-Tetroxane, 3,3,6,6-tetramethyl-

InChI
InChI=1S/C6H12O4/c1-5(2)7-9-6(3,4)10-8-5/h1-4H3
InChI Key
SJQITXILEOCXGI-UHFFFAOYSA-N
Formula
C6H12O4
SMILES
CC1(C)OOC(C)(C)OO1
Molecular Weight1
148.16
CAS
1073-91-2
Other Names
  • 1,2,4,5-Tetraoxacyclohexane, 3,3,6,6-tetramethyl
  • 3,3,6,6-tetramethyl-1,2,4,5-tetroxane
  • Acetone diperoxide
  • DADP
  • Diacetone peroxide
  • Diisopropylidene cyclic diperoxide
  • S-Tetroxane, 3,3,6,6-tetramethyl-
  • diacetone diperoxide
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Physical Properties

Property Value Unit Source
ΔfusH° 23.52 kJ/mol Joback Calculated Property
logPoct/wat 1.369 Crippen Calculated Property
McVol 108.020 ml/mol McGowan Calculated Property
Inp [837.20; 873.60]   Show Hide
Inp 840.90 NIST
Inp 861.60 NIST
Inp 837.20 NIST
Inp 860.70 NIST
Inp 873.60 NIST
Inp 849.80 NIST
Inp 848.90 NIST
Inp 865.00 NIST
Inp 873.00 NIST
Inp 858.90 NIST
Inp 840.90 NIST
Inp 849.80 NIST
Tfus [406.15; 406.15] K Show Hide
Tfus 406.15 K A comparative study on two explosive acetone peroxides
Tfus 406.15 K THERMOCHEMISTRY OF CYCLIC ACETONE PEROXIDES

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l 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 [158.50; 413.35] 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-9.29300e+01
Coefficient B1.24128e+00
Coefficient C-1.33780e-03
Coefficient D6.02800e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 158.50 J/mol×K 273.00 Calculated Property
Cp,gas 205.46 J/mol×K 353.78 Calculated Property
Cp,gas 243.31 J/mol×K 434.56 Calculated Property
Cp,gas 273.96 J/mol×K 515.33 Calculated Property
Cp,gas 299.32 J/mol×K 596.11 Calculated Property
Cp,gas 321.28 J/mol×K 676.89 Calculated Property
Cp,gas 341.76 J/mol×K 757.67 Calculated Property
Cp,gas 362.66 J/mol×K 838.44 Calculated Property
Cp,gas 385.89 J/mol×K 919.22 Calculated Property
Cp,gas 413.35 J/mol×K 1000.00 Calculated Property

Similar Compounds

TATP. 1,2,4,5-tetraoxacyclohexane, 3,6-dimethyl, 3,6-diethyl. 1,2,4,5,7,8-hexaoxacyclononane, 3,6,9-trimethyl, 3,6,9-triethyl. Peroxide, bis(1,1-dimethylethyl). 1,2,4,5-tetraoxacyclohexane, 3,3-dimethyl, 6,6-diethyl. 2,2-Bis(tert-butylperoxy) butane. 1,2,4,5-tetraoxacyclohexane, 3,6-dimethyl, 3,6-di-tertbutyl. 1,2,4,5,7,8-hexaoxacyclononane, 3,3,6,6-tetramethyl, 9,9-diethyl. 1,2,4,5,7,8-hexaoxacyclononane, 3,3-dimethyl, 6,6,9,9-tetraethyl. 1,2,4,5-tetraoxacyclohexane, 3,3,6,6-tetraethyl. 1,2,4,5,7,8-hexaoxacyclononane, 3,3,6,6,9,9-hexaethyl. Peroxide, bis(1-methylethyl). tert-Butyl Hydroperoxide. (CH3)3CO2. 1,2,4,5-tetraoxacyclohexane, 3,3,6,6-tetrapropyl.

Find more compounds similar to 1,2,4,5-Tetroxane, 3,3,6,6-tetramethyl-.

Sources

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