4,4'-Bis(α,α-dimethylbenzyl)diphenylamine

Product Information

Molecular Formula:
C30H31N
Molecular Weight:
405.58
Description
4,4'-Bis(α,α-dimethylbenzyl)diphenylamine is utilized in the biomedical field as an antioxidant and stabilizer for various polymers and elastomers. Its exceptional thermal stability and ability to inhibit oxidation make it a valuable component in preventing degradation of medicines and materials. It aids in extending the shelf-life and preserving the quality of drugs, ensuring their efficacy in treating various diseases.
Synonyms
4-(2-phenylpropan-2-yl)-N-[4-(2-phenylpropan-2-yl)phenyl]aniline; 10081-67-1; Bis[4-(2-phenyl-2-propyl)phenyl]amine; Naugard445; AntioxidantKY-405; 4,4'-Bis(alpha,alpha-dimethylbenzyl)diphenylamine
IUPAC Name
4-(2-phenylpropan-2-yl)-N-[4-(2-phenylpropan-2-yl)phenyl]aniline
Canonical SMILES
CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)NC3=CC=C(C=C3)C(C)(C)C4=CC=CC=C4
InChI
InChI=1S/C30H31N/c1-29(2,23-11-7-5-8-12-23)25-15-19-27(20-16-25)31-28-21-17-26(18-22-28)30(3,4)24-13-9-6-10-14-24/h5-22,31H,1-4H3
InChI Key
UJAWGGOCYUPCPS-UHFFFAOYSA-N
Boiling Point
535.2°C at 760 mmHg
Melting Point
100°C
Purity
95%
Density
1.061 g/cm3
Appearance
white to gray powder

Computed Properties

XLogP3
9.1
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
1
Rotatable Bond Count
6
Exact Mass
405.245649993 g/mol
Monoisotopic Mass
405.245649993 g/mol
Topological Polar Surface Area
12Ų
Heavy Atom Count
31
Formal Charge
0
Complexity
473
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes

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The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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