Name: Name:4,4',4''-Tris(n-3-methylphenyl-n-phenylamino)triphenylamine
Brand: Angene
SKU: AG0074DP
Rating: 90 (10 reviews)

4,4',4''-Tris(n-3-methylphenyl-n-phenylamino)triphenylamine

CAS No.:

124729-98-2

Catalog Number:

AG0074DP

Molecular Formula:

C57H48N4

Molecular Weight:

789.0178

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Product Description

Catalog Number:

AG0074DP

Chemical Name:

4,4',4''-Tris(n-3-methylphenyl-n-phenylamino)triphenylamine

CAS Number:

124729-98-2

Molecular Formula:

C57H48N4

Molecular Weight:

789.0178

MDL Number:

MFCD00799401

IUPAC Name:

4-N-(3-methylphenyl)-1-N,1-N-bis[4-(N-(3-methylphenyl)anilino)phenyl]-4-N-phenylbenzene-1,4-diamine

InChI:

InChI=1S/C57H48N4/c1-43-16-13-25-55(40-43)59(46-19-7-4-8-20-46)52-34-28-49(29-35-52)58(50-30-36-53(37-31-50)60(47-21-9-5-10-22-47)56-26-14-17-44(2)41-56)51-32-38-54(39-33-51)61(48-23-11-6-12-24-48)57-27-15-18-45(3)42-57/h4-42H,1-3H3

InChI Key:

DIVZFUBWFAOMCW-UHFFFAOYSA-N

SMILES:

Cc1cccc(c1)N(c1ccccc1)c1ccc(cc1)N(c1ccc(cc1)N(c1cccc(c1)C)c1ccccc1)c1ccc(cc1)N(c1cccc(c1)C)c1ccccc1

Properties

Complexity:

1090

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

788.388g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

789.039g/mol

Monoisotopic Mass:

788.388g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

13A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

Literature

Title	Journal
Electroactivity of a starburst hole-transport material in Langmuir-Blodgett films. Solid state effects and intervalence charge transfer.	Physical chemistry chemical physics : PCCP 20070614

Properties