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α-NPD

Catalog Number
ACM495416609
Product Name
α-NPD
Structure
CAS
495416-60-9
Category
Organic Light-Emitting Diode (OLED) Materials
IUPAC Name
N-[3-methyl-4-[2-methyl-4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine
Molecular Weight
616.8g/mol
Molecular Formula
C46H36N2
Canonical SMILES
CC1=C(C=CC(=C1)N(C2=CC=CC=C2)C3=CC=CC4=CC=CC=C43)C5=C(C=C(C=C5)N(C6=CC=CC=C6)C7=CC=CC8=CC=CC=C87)C
InChI
InChI=1S/C46H36N2/c1-33-31-39(47(37-19-5-3-6-20-37)45-25-13-17-35-15-9-11-23-43(35)45)27-29-41(33)42-30-28-40(32-34(42)2)48(38-21-7-4-8-22-38)46-26-14-18-36-16-10-12-24-44(36)46/h3-32H,1-2H3
InChI Key
ZJFKMIYGRJGWIB-UHFFFAOYSA-N
Complexity
903
Covalently-Bonded Unit Count
1
Exact Mass
616.287849g/mol
Formal Charge
0
Heavy Atom Count
48
Monoisotopic Mass
616.287849g/mol
Rotatable Bond Count
7
XLogP3
13.3
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