n4,n4'-Di-1-naphthalenyl-n4,n4'-di-2-naphthalenyl-[1,1'-biphenyl]-4,4'-diamine

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Catalog Number
ACM374592888-2
Product Name
n4,n4'-Di-1-naphthalenyl-n4,n4'-di-2-naphthalenyl-[1,1'-biphenyl]-4,4'-diamine
Structure
Structure
CAS
374592-88-8
Category
Heterocyclic Organic Compound
Synonyms
N,N'-Di-1-naphthyl-N,N'-di-2-naphthylbenzidine;N-naphthalen-1-yl-N-[4-[4-[naphthalen-1-yl(naphthalen-2-yl)amino]phenyl]phenyl]naphthalen-2-amine;Atbeta-tnb;SCHEMBL75616
IUPAC Name
N-naphthalen-1-yl-N-[4-[4-[naphthalen-1-yl(naphthalen-2-yl)amino]phenyl]phenyl]naphthalen-2-amine
Molecular Weight
688.9
Molecular Formula
C52H36N2
Canonical SMILES
C1=CC=C2C=C(C=CC2=C1)N(C3=CC=C(C=C3)C4=CC=C(C=C4)N(C5=CC6=CC=CC=C6C=C5)C7=CC=CC8=CC=CC=C87)C9=CC=CC1=CC=CC=C19
InChI
InChI=1S/C52H36N2/c1-3-15-43-35-47(33-27-37(43)11-1)53(51-21-9-17-41-13-5-7-19-49(41)51)45-29-23-39(24-30-45)40-25-31-46(32-26-40)54(48-34-28-38-12-2-4-16-44(38)36-48)52-22-10-18-42-14-6-8-20-50(42)52/h1-36H
InChI Key
RYZPDEZIQWOVPJ-UHFFFAOYSA-N
Boiling Point
134 °C
Density
1.244 g/ml
Complexity
1070
Covalently-Bonded Unit Count
1
Exact Mass
688.287849g/mol
Formal Charge
0
H-Bond Acceptor
2
H-Bond Donor
0
Heavy Atom Count
54
Monoisotopic Mass
688.287849g/mol
Rotatable Bond Count
7
XLogP3
15
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