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9,9',10,10'-Tetraphenyl-2,2'-bianthracene, ≥97%

Catalog Number
ACM172285722-2
CAS Number
172285-72-2
Product Name
9,9',10,10'-Tetraphenyl-2,2'-bianthracene, ≥97%
Structure
Category
Organic Light-Emitting Diode (OLED) Materials
IUPAC Name
2-(9,10-diphenylanthracen-2-yl)-9,10-diphenylanthracene
Molecular Weight
658.8g/mol
Molecular Formula
C52H34
Canonical SMILES
C1=CC=C(C=C1)C2=C3C=CC(=CC3=C(C4=CC=CC=C42)C5=CC=CC=C5)C6=CC7=C(C8=CC=CC=C8C(=C7C=C6)C9=CC=CC=C9)C1=CC=CC=C1
InChI
InChI=1S/C52H34/c1-5-17-35(18-6-1)49-41-25-13-15-27-43(41)51(37-21-9-3-10-22-37)47-33-39(29-31-45(47)49)40-30-32-46-48(34-40)52(38-23-11-4-12-24-38)44-28-16-14-26-42(44)50(46)36-19-7-2-8-20-36/h1-34H
InChI Key
BHPFDLWDNJSMOS-UHFFFAOYSA-N
Complexity
1020
Covalently-Bonded Unit Count
1
Exact Mass
658.266051g/mol
Formal Charge
0
Heavy Atom Count
52
Monoisotopic Mass
658.266051g/mol
Rotatable Bond Count
5
XLogP3
15.1
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