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1,4-Phthalazinedione
[CAS# 20116-64-7]

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Identification
Name 1,4-Phthalazinedione
Synonyms Phthalazine-1,4-Quinone; Aids-127041; Aids127041
Molecular Structure CAS#: 20116-64-7, 1,4-Phthalazinedione
Molecular Formula C8H4N2O2
Molecular Weight 160.13
CAS Registry Number 20116-64-7
SMILES C1=CC=CC2=C1C(N=NC2=O)=O
InChI 1S/C8H4N2O2/c11-7-5-3-1-2-4-6(5)8(12)10-9-7/h1-4H
InChIKey YSZIOXAEADAJLX-UHFFFAOYSA-N
Properties
Density 1.48g/cm3 (Cal.)
Boiling point 318.112°C at 760 mmHg (Cal.)
Flash point 130.076°C (Cal.)
References
(1) Johnston Karen A.. Concise routes to pyrazolo[1,5-a]pyridin-3-yl pyridazin-3-ones, Organic & Biomolecular Chemistry, 2008
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