Chemical Properties of Acetamide, n-(3,7-dinitro-9-oxofluoren-2-yl)-, (CAS 100964-96-3)

Acetamide, n-(3,7-dinitro-9-oxofluoren-2-yl)-,

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InChI
InChI=1S/C15H9N3O6/c1-7(19)16-13-5-12-10(6-14(13)18(23)24)9-3-2-8(17(21)22)4-11(9)15(12)20/h2-6H,1H3,(H,16,19)
InChI Key
AAGDPOKIFBYAMI-UHFFFAOYSA-N
Formula
C15H9N3O6
SMILES
CC(=O)Nc1cc2c(cc1[N+](=O)[O-])-c1ccc([N+](=O)[O-])cc1C2=O
Molecular Weight1
327.25
CAS
100964-96-3
Sources

Physical Properties

Property Value Unit Source
Δf 253.73 kJ/mol Joback Calculated Property
Δfgas -50.09 kJ/mol Joback Calculated Property
Δfus 50.94 kJ/mol Joback Calculated Property
Δvap 107.33 kJ/mol Joback Calculated Property
logPoct/wat 2.67 Crippen Calculated Property
Pc 3009.03 kPa Joback Calculated Property
Tboil 1099.27 K Joback Calculated Property
Tc 1380.87 K Joback Calculated Property
Tfus 861.50 K Joback Calculated Property
Vc 0.85 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 647.53 J/mol×K 1099.27 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>C=O (ring) 1
=CH- (ring) 5
-NO2 2
>NH 1
=C< (ring) 7
-CH3 1
>C=O (nonring) 1

Similar Compounds

2,6-Dinitro-9h-fluoren-9-one. 9H-fluoren-9-one, 2,4,5,7-tetranitro-. 2,4,7-Trinitrofluorenone. 9H-fluoren-9-one, 2,7-dinitro-. 9H-fluoren-9-one, 3-nitro-. (1R,9S)-1-Acetoxy-N-acetyl-1,9-dihydro-anhydronornarceine. Tetracycline hydrochloride. Chlortetracycline hydrochloride. Heptafluorobutyryl-codeine. Etorphine. Octaethyl-porphyrin, Si-(OTBDMS)2-derivative. Nalmefene, bis(trifluoroacetate). 6-O,N-Diacetylnorcodeine. Acetimide, N-(6,7,9,10-tetrahydro-1,2,3,10-tetramethoxy-9-oxo-5H-10,12a-epoxybenzo(a)heptalen-7-yl)-. Pseudomorphine.

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