Structure

VNPB

CAS
1010396-31-2
Catalog Number
ACM1010396312-1
Category
Organic Light Emitting Diode (OLED)
Molecular Weight
640.81 g/mol
Molecular Formula
C48H36N2

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Specification

Synonyms
N4,N4'-Di (naphtha len-1-y l)-N4,N4'-bis (4-viny lpheny l)bipheny l-4,4'-diamine
IUPAC Name
N-[4-[4-(4-ethenyl-N-naphthalen-1-ylanilino)phenyl]phenyl]-N-(4-ethenylphenyl)naphthalen-1-amine
Canonical SMILES
C=CC(C=C1)=CC=C1N(C2=CC=CC3=C2C=CC=C3)C(C=C4)=CC=C4C5=CC=C(N(C6=CC=C(C=C)C=C6)C7=CC=CC8=C7C=CC=C8)C=C5
InChI
1S/C48H36N2/c1-3-35-19-27-41(28-20-35)49(47-17-9-13-39-11-5-7-15-45(39)47)43-31-23-37(24-32-43)38-25-33-44(34-26-38)50(42-29-21-36(4-2)22-30-42)48-18-10-14-40-12-6-8-16-46(40)48/h3-34H,1-2H2,WTEWXIOJLNVYBZ-UHFFFAOYSA-N
InChI Key
WTEWXIOJLNVYBZ-UHFFFAOYSA-N
Solubility
Toluene, Chloroform
Storage
room temp
Complexity
966
Covalently-Bonded Unit Count
1
Exact Mass
640.287849g/mol
Formal Charge
0
Grade
>98% / >95%
H-Bond Acceptor
2
H-Bond Donor
0
Heavy Atom Count
50
MDL Number
MFCD27978272
Monoisotopic Mass
640.287849g/mol
PL Peak
450 nm (in THF)
Rotatable Bond Count
9
UV Peak
359 nm (in THF)
XLogP3
14.1
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