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1,4-Diazabicyclo[2.2.2]octane DihydroBromide

Catalog Number
ACM54581690-2
CAS Number
54581-69-0
Product Name
1,4-Diazabicyclo[2.2.2]octane DihydroBromide
Category
Electronic Materials; Perovskite Solar Cell (PSC) Materials
IUPAC Name
1,4-diazabicyclo[2.2.2]octane;dihydrobromide
Molecular Weight
274.00 g/mol
Molecular Formula
C6H12N2•2HBr
Canonical SMILES
C1CN2CCN1CC2.Br.Br
InChI
InChI=1S/C6H12N2.2BrH/c1-2-8-5-3-7(1)4-6-8;;/h1-6H2;2*1H
InChI Key
GPELLQBNVCIHJJ-UHFFFAOYSA-N
Melting Point
319 °C
Purity
>98.0%(T)(N)
Appearance
White to Almost white powder to crystal
Storage
Store under inert gas
Color
White to Almost White Powder to crystal
Complexity
61.5
Covalently-Bonded Unit Count
3
Exact Mass
273.95032g/mol
Form
Solid
Formal Charge
0
Hazard Statements
H315 : Causes skin irritation.H319 : Causes serious eye irritation.
Heavy Atom Count
10
MDL Number
MFCD00035465
Monoisotopic Mass
271.95237g/mol
Precautionary Statements
P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ eye protection/ face protection.P337 + P313 : If eye irritation persists: Get medical advice/ attention.P305 + P351 + P338 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.P302 + P352 : IF ON SKIN: Wash with plenty of soap and water.P332 + P313 : If skin irritation occurs: Get medical advice/ attention.P362 : Take off contaminated clothing and wash before reuse.
Rotatable Bond Count
0
Signal Word
Warning
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