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9,10-Bis[N-(2-naphthyl)anilino]anthracene

Catalog Number
ACM473717087-1
Product Name
9,10-Bis[N-(2-naphthyl)anilino]anthracene
CAS
473717-08-7
Category
Organic Light-Emitting Diode (OLED) Materials
Synonyms
N,N'-Di(naphthalen-2-yl)-N,N'-diphenylanthracene-9,10-diamine
IUPAC Name
9-N,10-N-dinaphthalen-2-yl-9-N,10-N-diphenylanthracene-9,10-diamine
Molecular Weight
612.78
Molecular Formula
C46H32N2
Canonical SMILES
C1=CC=C(C=C1)N(C2=CC3=CC=CC=C3C=C2)C4=C5C=CC=CC5=C(C6=CC=CC=C64)N(C7=CC=CC=C7)C8=CC9=CC=CC=C9C=C8
InChI
InChI=1S/C46H32N2/c1-3-19-37(20-4-1)47(39-29-27-33-15-7-9-17-35(33)31-39)45-41-23-11-13-25-43(41)46(44-26-14-12-24-42(44)45)48(38-21-5-2-6-22-38)40-30-28-34-16-8-10-18-36(34)32-40/h1-32H
InChI Key
LIBLRJBCMMHCHS-UHFFFAOYSA-N
Melting Point
208 °C
Purity
95%+
Appearance
White to Yellow to Orange powder to crystal
Storage
Store under inert gas
Complexity
908
Covalently-Bonded Unit Count
1
Exact Mass
612.256549g/mol
Formal Charge
0
Hazard Statements
H315 : Causes skin irritation.H319 : Causes serious eye irritation.
Heavy Atom Count
48
MDL Number
MFCD00041869
Monoisotopic Mass
612.256549g/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
6
Signal Word
Warning
XLogP3
13.4
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