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6-Nitro-2-Piperazin-1-Yl-Quinoline
[CAS# 77372-73-7]

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Identification
Name 6-Nitro-2-Piperazin-1-Yl-Quinoline
Synonyms 6-Nitro-2-Piperazin-1-Yl-Quinoline; 6-Nitro-2-(1-Piperazinyl)Quinoline; Ncgc00162315-02
Molecular Structure CAS#: 77372-73-7, 6-Nitro-2-Piperazin-1-Yl-Quinoline
Molecular Formula C13H14N4O2
Molecular Weight 258.28
CAS Registry Number 77372-73-7
SMILES C1=CC(=CC2=CC=C(N=C12)N3CCNCC3)[N+](=O)[O-]
InChI 1S/C13H14N4O2/c18-17(19)11-2-3-12-10(9-11)1-4-13(15-12)16-7-5-14-6-8-16/h1-4,9,14H,5-8H2
InChIKey GGDBEAVVGFNWIA-UHFFFAOYSA-N
Properties
Density 1.312g/cm3 (Cal.)
Boiling point 484.353°C at 760 mmHg (Cal.)
Flash point 246.728°C (Cal.)
References
(1) Kokel et al.. Rapid behavior-based identification of neuroactive small molecules in the zebrafish, Nature Chemical Biology, 2010
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