Chemical Properties of Methane,(2-fluoro-2,2-dinitroethoxy)(2,2,2-trinitroethoxy)- (CAS 30893-52-8)

Methane,(2-fluoro-2,2-dinitroethoxy)(2,2,2-trinitroethoxy)-

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InChI
InChI=1S/C5H6FN5O12/c6-4(7(12)13,8(14)15)1-22-3-23-2-5(9(16)17,10(18)19)11(20)21/h1-3H2
InChI Key
AEKWETJEQDKAET-UHFFFAOYSA-N
Formula
C5H6FN5O12
SMILES
O=[N+]([O-])C(F)(COCOCC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]
Molecular Weight1
347.13
CAS
30893-52-8
Sources

Physical Properties

Property Value Unit Source
Δcliquid -2419.10 ± 2.90 kJ/mol NIST
Δf -230.16 kJ/mol Joback Calculated Property
Δfgas -678.38 kJ/mol Joback Calculated Property
Δfliquid -642.00 ± 13.00 kJ/mol NIST
Δfus 56.14 kJ/mol Joback Calculated Property
Δvap 111.09 kJ/mol Joback Calculated Property
logPoct/wat -1.36 Crippen Calculated Property
Pc 3547.31 kPa Joback Calculated Property
Tboil 1110.65 K Joback Calculated Property
Tc 1397.84 K Joback Calculated Property
Tfus 914.05 K Joback Calculated Property
Vc 0.76 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 566.04 J/mol×K 1110.65 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
-CH2- 3
-F 1
>C< 2
-NO2 5

Similar Compounds

3,5,7-Trioxa-1,1,1,9,9,9-hexanitrononane. Tris(2,2,2-trinitroethyl)orthoformate. Difluoro-bis(2-fluoro-2,2-dinitroethoxy)methane. Tetrabis(2,2,2-trinitroethyl(orthocarbonate. 1,1,1-Trinitro-2-ethoxypropane. Fluoropentanitroethane. Butanoic acid, 4,4,4-trinitro-, 2,2,2-trinitroethyl ester. 2-Methoxy-4,6-bis(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine. 2,4,6-Tris(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine. 2,4-Dimethoxy-6-(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine. 1,7-Difluoro-1,1,5,7,7-pentanitro-5-aza-3-oxaheptane. Butyronitrile, 4,4,4-trinitro-. Ethane, 1,1,1-trinitro-. Butyric acid, 4,4,4-trinitro-, ethyl ester. 1-Fluoro-1,1-dinitroethane.

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