Chemical Properties of Butanoic acid, 4,4,4-trinitro-, 2,2,2-trinitroethyl ester (CAS 866-65-9)

Butanoic acid, 4,4,4-trinitro-, 2,2,2-trinitroethyl ester

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InChI
InChI=1S/C6H6N6O14/c13-4(1-2-5(7(14)15,8(16)17)9(18)19)26-3-6(10(20)21,11(22)23)12(24)25/h1-3H2
InChI Key
IAVWMTSJZOZYCU-UHFFFAOYSA-N
Formula
C6H6N6O14
SMILES
O=C(CCC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])OCC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]
Molecular Weight1
386.14
CAS
866-65-9
Other Names
  • Butyric acid, 4,4,4-trinitro-, 2,2,2-trinitroethyl ester
  • 4,4,4-Trinitrobutyric acid 2,2,2-trinitroethyl ester
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Physical Properties

Property Value Unit Source
Δf -15.30 kJ/mol Joback Calculated Property
Δfgas -494.03 kJ/mol Joback Calculated Property
Δfus 67.42 kJ/mol Joback Calculated Property
Δvap 135.06 kJ/mol Joback Calculated Property
log10WS -3.91 Crippen Calculated Property
logPoct/wat -1.722 Crippen Calculated Property
McVol 207.360 ml/mol McGowan Calculated Property
Pc 3727.11 kPa Joback Calculated Property
Tboil 1317.55 K Joback Calculated Property
Tc 1631.23 K Joback Calculated Property
Tfus 1096.04 K Joback Calculated Property
Vc 0.866 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [646.20; 682.39] J/mol×K [1317.55; 1631.23] Show Hide
Cp,gas 646.20 J/mol×K 1317.55 Joback Calculated Property
Cp,gas 650.44 J/mol×K 1369.83 Joback Calculated Property
Cp,gas 655.09 J/mol×K 1422.11 Joback Calculated Property
Cp,gas 660.40 J/mol×K 1474.39 Joback Calculated Property
Cp,gas 666.57 J/mol×K 1526.67 Joback Calculated Property
Cp,gas 673.82 J/mol×K 1578.95 Joback Calculated Property
Cp,gas 682.39 J/mol×K 1631.23 Joback Calculated Property

Similar Compounds

Butyric acid, 4,4,4-trinitro-, ethyl ester. Isonipecotic acid, N-(3-methoxybenzoyl)-, butyl ester. Isonipecotic acid, N-(3-methoxybenzoyl)-, ethyl ester. Isonipecotic acid, N-(3-methoxybenzoyl)-, pentyl ester. Isonipecotic acid, N-(3-methoxybenzoyl)-, propyl ester. Isonipecotic acid, N-benzoyl-, butyl ester. Isonipecotic acid, N-(3-methoxybenzoyl)-, heptyl ester. Isonipecotic acid, N-(3-methoxybenzoyl)-, hexyl ester. Isonipecotic acid, N-(3-methoxybenzoyl)-, isobutyl ester. Isonipecotic acid, N-(3-methoxybenzoyl)-, decyl ester. Isonipecotic acid, N-(3-methoxybenzoyl)-, nonyl ester. Isonipecotic acid, N-(3-methoxybenzoyl)-, octyl ester. Isonipecotic acid, N-(3-methoxybenzoyl)-, isohexyl ester. Isonipecotic acid, N-(3-methoxybenzoyl)-, undecyl ester. Isonipecotic acid, N-(2-methoxybenzoyl)-, butyl ester.

Find more compounds similar to Butanoic acid, 4,4,4-trinitro-, 2,2,2-trinitroethyl ester.

Sources

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