Chemical Properties of Butyramide, 4,4,4-trinitro- (CAS 13000-42-5)

Butyramide, 4,4,4-trinitro-

InChI
InChI=1S/C4H6N4O7/c5-3(9)1-2-4(6(10)11,7(12)13)8(14)15/h1-2H2,(H2,5,9)
InChI Key
HNLKKBHYPDVWGZ-UHFFFAOYSA-N
Formula
C4H6N4O7
SMILES
NC(=O)CCC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]
Molecular Weight1
222.11
CAS
13000-42-5
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Physical Properties

Property Value Unit Source
Δfsolid -214.60 ± 1.20 kJ/mol NIST
Δfus 39.58 kJ/mol Joback Calculated Property
logPoct/wat -1.264 Crippen Calculated Property
McVol 131.030 ml/mol McGowan Calculated Property

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Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [375.50; 403.64] J/mol×K [869.61; 1148.79] Show Hide
Cp,gas 375.50 J/mol×K 869.61 Joback Calculated Property
Cp,gas 381.57 J/mol×K 916.14 Joback Calculated Property
Cp,gas 386.95 J/mol×K 962.67 Joback Calculated Property
Cp,gas 391.75 J/mol×K 1009.20 Joback Calculated Property
Cp,gas 396.06 J/mol×K 1055.73 Joback Calculated Property
Cp,gas 399.99 J/mol×K 1102.26 Joback Calculated Property
Cp,gas 403.64 J/mol×K 1148.79 Joback Calculated Property

Similar Compounds

Butyronitrile, 4,4,4-trinitro-. Butyric acid, 4,4,4-trinitro-, ethyl ester. Butanoic acid, 4,4,4-trinitro-, 2,2,2-trinitroethyl ester. 1,1,4,4-Tetranitrocyclohexane. Propionamide, 3-benzoyl-. Asn, N-isoBOC TBDMS. Asparagine, ethoxycarbonylated, TBDMS. 1-Pyrrolidinyloxy, 3-(aminocarbonyl)-2,2,5,5-tetramethyl-. tert-Butyldimethylsilyl 4-(1-(tert-butyldimethylsilyl)-2,2-dimethylhydrazino)-4-oxobutanoate. ETOXAZOLE. Phenothiazine-3-propionic acid, 10-methyl-, hydrazide. L-Proline, 4-[(tert-butyldimethylsilyl)oxy]-1-(tert-butyldimethylsilyl)-, tert-butyldimethylsilyl ester. L-Proline, 1-(tert-butyldimethylsilyl)-5-oxo-, tert-butyldimethylsilyl ester. 2-Pyrrolidinone, 3-hydroxy-1-methyl-5-(3-pyridinyl)-, (3R-trans)-. RTI 17.

Find more compounds similar to Butyramide, 4,4,4-trinitro-.

Sources

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