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N,N,N',N'-Tetrakis(p-tolyl)benzidine

Catalog Number
ACM76185654
Product Name
N,N,N',N'-Tetrakis(p-tolyl)benzidine
Structure
CAS
76185-65-4
Category
Semiconducting Materials
Synonyms
N,N,N',N'-Tetrakis(4-methylphenyl)benzidine (purified by sublimation)
IUPAC Name
4-methyl-N-[4-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]phenyl]-N-(4-methylphenyl)aniline
Molecular Weight
544.74
Molecular Formula
C40H36N2
Canonical SMILES
CC1=CC=C(C=C1)N(C2=CC=C(C=C2)C)C3=CC=C(C=C3)C4=CC=C(C=C4)N(C5=CC=C(C=C5)C)C6=CC=C(C=C6)C
InChI
InChI=1S/C40H36N2/c1-29-5-17-35(18-6-29)41(36-19-7-30(2)8-20-36)39-25-13-33(14-26-39)34-15-27-40(28-16-34)42(37-21-9-31(3)10-22-37)38-23-11-32(4)12-24-38/h5-28H,1-4H3
InChI Key
MVIXNQZIMMIGEL-UHFFFAOYSA-N
Melting Point
218 °C
Purity
>98.0%(HPLC)(N)
Solubility
soluble in Tetrahydrofuran
Appearance
White to Almost white powder to crystal
Storage
Store under inert gas
Complexity
652
Covalently-Bonded Unit Count
1
EC Number
616-303-1
Exact Mass
544.287849g/mol
Formal Charge
0
Hazard Statements
H411 : Toxic to aquatic life with long lasting effects.
Heavy Atom Count
42
MDL Number
MFCD00799300
Monoisotopic Mass
544.287849g/mol
Precautionary Statements
P501 : Dispose of contents/ container to an approved waste disposal plant.P273 : Avoid release to the environment.P391 : Collect spillage.
Rotatable Bond Count
7
Signal Word
Warning
XLogP3
11.5
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