Chemical Properties of 1,3-Dinitro-1,3-diazacycloheptane (CAS 5754-90-5)

1,3-Dinitro-1,3-diazacycloheptane

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InChI
InChI=1S/C5H10N4O4/c10-8(11)6-3-1-2-4-7(5-6)9(12)13/h1-5H2
InChI Key
XFBIFYVTPFYRSQ-UHFFFAOYSA-N
Formula
C5H10N4O4
SMILES
O=[N+]([O-])N1CCCCN([N+](=O)[O-])C1
Molecular Weight1
190.16
CAS
5754-90-5
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Physical Properties

Property Value Unit Source
log10WS -1.59 Crippen Calculated Property
logPoct/wat -0.275 Crippen Calculated Property
McVol 125.250 ml/mol McGowan Calculated Property
Tfus [374.00; 376.00] K Show Hide
Tfus 374.00 ± 0.10 K NIST
Tfus 376.00 ± 1.00 K NIST

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
ΔfusH 2.80 kJ/mol 374.00 NIST

Similar Compounds

1,3-Dinitro-1,3-diazacyclohexane. 4,5,6,7-Tetrahydropyrazolo[1,5-d][1,2,4]-triazin-4-one, 5-butyl-2,6-dimethyl. 4,5,6,7-Tetrahydropyrazolo[1,5-d][1,2,4]-triazin-4-one, 5-propyl-2,6-dimethyl. guanine. cannabinolic acid, methyl-boronate. Pregnan-2,3,20-triol, GlcNAc, MeTMS. 5-«alpha»-Pregnan-3-«beta»-ol, 20-«alpha»-GlcNAc, MeTMS. 4-Hydroxyoestrone (enol), TMS. Indomethacin, pentyl ester. Metergoline. 13«alpha»-Tigloyloxymultiflorine. N-Acetyl-D-glucosamine, tetrakis(trimethylsilyl) ether (isomer 2). Carteolol, PFB-TMS. N-Acetyl-D-glucosamine, tetrakis(trimethylsilyl) ether (isomer 1). Pinobanksin-3-isobutanoate, bis-TMS.

Find more compounds similar to 1,3-Dinitro-1,3-diazacycloheptane.

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