Chemical Properties of 2,4,6-Trinitropyridine 1-oxide (CAS 25242-76-6)

2,4,6-Trinitropyridine 1-oxide

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InChI
InChI=1S/C5H2N4O7/c10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h1-2H
InChI Key
DQQZMAWSHWQSSF-UHFFFAOYSA-N
Formula
C5H2N4O7
SMILES
O=[N+]([O-])c1cc([N+](=O)[O-])[n+]([O-])c([N+](=O)[O-])c1
Molecular Weight1
230.09
CAS
25242-76-6
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Physical Properties

Property Value Unit Source
ΔcH°solid -2355.60 ± 1.30 kJ/mol NIST
ΔfH°solid 102.10 ± 1.30 kJ/mol NIST
ΔsubH° 106.30 ± 2.90 kJ/mol NIST
log10WS -4.95 Crippen Calculated Property
logPoct/wat 0.045 Crippen Calculated Property
McVol 125.660 ml/mol McGowan Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
ΔsubH 106.30 ± 2.90 kJ/mol 390.00 NIST

Similar Compounds

L-Alanine, N-[N-[N-[N-(1-oxodecyl)glycyl]-L-tryptophyl]-L-alanyl]-, methyl ester. Flavone-3-rutinoside, 3,3',4',5,7-pentahydroxy. RTI 23. Quinapril desethyl - H2O Me (Quinaprilate - H2O Me). Nomifensine M(HO), diacetylated, isomer # 1. Hydroxyaphyllidine. Argyrolobine. Floxuridine. Quinapril desethyl 3Me (Quinaprilate 3Me). Oxazolam. cis-Phenanthrene, 9,10-dihydro-9-methyl-9,10-diol, 3,4-dimethoxy, butylboronate. RTI 12. Tetrabenazine M (bis-desmethyl-HO-), diacetylated. Uridine, 2',3'-O-(1-methylethylidene)-. Tetrabenazine M (bis-desmethyl-), monoacetylated.

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