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9,9-Bis[4-[N-(1-naphthyl)anilino]phenyl]fluorene

Catalog Number
ACM510775243-1
Product Name
9,9-Bis[4-[N-(1-naphthyl)anilino]phenyl]fluorene
Structure
CAS
510775-24-3
Category
Organic Light-Emitting Diode (OLED) Materials
Synonyms
N-[4-[9-[4-(N-Naphthalen-1-Ylanilino)Phenyl]Fluoren-9-Yl]Phenyl]-N-Phenylnaphthalen-1-Amine
IUPAC Name
N-[4-[9-[4-(N-naphthalen-1-ylanilino)phenyl]fluoren-9-yl]phenyl]-N-phenylnaphthalen-1-amine
Molecular Weight
752.96
Molecular Formula
C57H40N2
Canonical SMILES
C1=CC=C(C=C1)N(C2=CC=C(C=C2)C3(C4=CC=CC=C4C5=CC=CC=C53)C6=CC=C(C=C6)N(C7=CC=CC=C7)C8=CC=CC9=CC=CC=C98)C1=CC=CC2=CC=CC=C21
InChI
InChI=1S/C57H40N2/c1-3-21-45(22-4-1)58(55-31-15-19-41-17-7-9-25-49(41)55)47-37-33-43(34-38-47)57(53-29-13-11-27-51(53)52-28-12-14-30-54(52)57)44-35-39-48(40-36-44)59(46-23-5-2-6-24-46)56-32-16-20-42-18-8-10-26-50(42)56/h1-40H
InChI Key
LKFCORSLOUZJMB-UHFFFAOYSA-N
Melting Point
480 °C
Purity
95%+
Appearance
White to Orange to Green powder to crystal
Storage
Store under inert gas
Complexity
1210
Covalently-Bonded Unit Count
1
Exact Mass
752.319149g/mol
Formal Charge
0
Hazard Statements
H413 : May cause long lasting harmful effects to aquatic life.
Heavy Atom Count
59
MDL Number
MFCD00010719
Monoisotopic Mass
752.319149g/mol
Precautionary Statements
P501 : Dispose of contents/ container to an approved waste disposal plant.P273 : Avoid release to the environment.
Rotatable Bond Count
8
XLogP3
15.6
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