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3,6-Dibromo-9,10-phenanthrenequinone

Catalog Number
ACM53348053-1
CAS Number
53348-05-3
Product Name
3,6-Dibromo-9,10-phenanthrenequinone
Structure
Category
Organic Light-Emitting Diode (OLED) Materials
IUPAC Name
3,6-dibromophenanthrene-9,10-dione
Molecular Weight
366g/mol
Molecular Formula
C14H6Br2O2
Canonical SMILES
C1=CC2=C(C=C1Br)C3=C(C=CC(=C3)Br)C(=O)C2=O
InChI
InChI=1S/C14H6Br2O2/c15-7-1-3-9-11(5-7)12-6-8(16)2-4-10(12)14(18)13(9)17/h1-6H
InChI Key
WPEJBJRFPBMVGJ-UHFFFAOYSA-N
Complexity
346
Covalently-Bonded Unit Count
1
Exact Mass
365.87141g/mol
Formal Charge
0
Heavy Atom Count
18
MeSH Entry Terms
3,6-dibromophenanthrene-9,10-quinone
Monoisotopic Mass
363.87345g/mol
NSC Number
87364
Rotatable Bond Count
0
XLogP3
3.9
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