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1,4-Diazabicyclo[2.2.2]octane
[CAS# 88935-43-7]

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Identification
Name 1,4-Diazabicyclo[2.2.2]octane
Synonyms 1,4-Diaza[2.2.2]bicyclooctane; 1,4-Diazabicyclo [2.2.2] octane; 1,4-Diazabicyclo(2.2.2)octane
Molecular Formula C6H12N2
Molecular Weight 112.17
CAS Registry Number 88935-43-7
SMILES C1CN2CCN1CC2
InChI 1S/C6H12N2/c1-2-8-5-3-7(1)4-6-8/h1-6H2
InChIKey IMNIMPAHZVJRPE-UHFFFAOYSA-N
Properties
Density 1.1±0.1g/cm3 (Cal.)
1.14 (Expl.)
Melting point 158-160°C (Expl.)
Boiling point 174-176°C (Expl.)
173.999°C at 760 mmHg (Cal.)
Flash point 62.222°C (Cal.)
62°C (Expl.)
solubility Soluble in water, ethanol, benzene, ketones
Safety Data
Safety Code S26;S36/37/39;S60  Details
Risk Code R11;R22;R37/38;R41  Details
Hazard Symbol symbol  symbol  X;F  Details
Transport Information UN1325
Safety Description WARNING: Irritates skin and eyes, harmful if swallowed
Safety glasses, gloves, adequate ventilation.
References
(1) Paola Ceroni, Alberto Credi, Margherita Venturi and Vincenzo Balzani. Light-powered molecular devices and machines, Photochem. Photobiol. Sci., 2010, 9, 1561.
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List of Reports Available for 1,4-Diazabicyclo[2.2.2]octane
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