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5,5-dibromo-8,8-biquinoline

Catalog Number
ACM1148152491
CAS Number
1148152-49-1
Product Name
5,5-dibromo-8,8-biquinoline
Category
Organic Light-Emitting Diode (OLED) Materials
IUPAC Name
5,5-dibromo-8-quinolin-8-yl-6H-quinoline
Molecular Weight
416.1g/mol
Molecular Formula
C18H12Br2N2
Canonical SMILES
C1C=C(C2=C(C1(Br)Br)C=CC=N2)C3=CC=CC4=C3N=CC=C4
InChI
InChI=1S/C18H12Br2N2/c19-18(20)9-8-14(17-15(18)7-3-11-22-17)13-6-1-4-12-5-2-10-21-16(12)13/h1-8,10-11H,9H2
InChI Key
KTDJXBUFJWPKCG-UHFFFAOYSA-N
Complexity
448
Covalently-Bonded Unit Count
1
Exact Mass
415.93467g/mol
Formal Charge
0
Heavy Atom Count
22
Monoisotopic Mass
413.93672g/mol
Rotatable Bond Count
1
XLogP3
4.4
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