Home Chemical Structure 4-Methyldiphenylamine

Chemical Structure of 4-Methyldiphenylamine (C13H13N)

Identification of 4-Methyldiphenylamine Chemical Compound

2D chemical structure image of 4-Methyldiphenylamine
Chemical Formula C13H13N
Molecular Weight 183.24902 g/mol
IUPAC Name 4-methyl-N-phenylaniline
SMILES String Cc2ccc(Nc1ccccc1)cc2
InChI InChI=1S/C13H13N/c1-11-7-9-13(10-8-11)14-12-5-3-2-4-6-12/h2-10,14H,1H3
InChIKey AGHYMXKKEXDUTA-UHFFFAOYSA-N

Chemical Structure Description

A chemical structure of a molecule includes the arrangement of atoms and the chemical bonds that hold the atoms together. The 4-Methyldiphenylamine molecule contains a total of 28 bond(s). There are 15 non-H bond(s), 12 multiple bond(s), 2 rotatable bond(s), 12 aromatic bond(s), 2 six-membered ring(s) and 1 secondary amine(s) (aromatic).
Images of the chemical structure of 4-Methyldiphenylamine are given below:

2D chemical structure image of 4-Methyldiphenylamine
2-dimensional (2D) chemical structure image of 4-Methyldiphenylamine
3D chemical structure image of 4-Methyldiphenylamine
3-dimensional (3D) chemical structure image of 4-Methyldiphenylamine

The 2D chemical structure image of 4-Methyldiphenylamine is also called skeletal formula, which is the standard notation for organic molecules. The carbon atoms in the chemical structure of 4-Methyldiphenylamine are implied to be located at the corner(s) and hydrogen atoms attached to carbon atoms are not indicated – each carbon atom is considered to be associated with enough hydrogen atoms to provide the carbon atom with four bonds.

The 3D chemical structure image of 4-Methyldiphenylamine is based on the ball-and-stick model which displays both the three-dimensional position of the atoms and the bonds between them. The radius of the spheres is therefore smaller than the rod lengths in order to provide a clearer view of the atoms and bonds throughout the chemical structure model of 4-Methyldiphenylamine.


An Interactive 3-dimensional (3D) Visualization of 4-Methyldiphenylamine

For a better understanding of the chemical structure, an interactive 3D visualization of 4-Methyldiphenylamine is provided here.

The 4-Methyldiphenylamine molecule shown in the visualization screen can be rotated interactively by keep clicking and moving the mouse button. Mouse wheel zoom is available as well – the size of the 4-Methyldiphenylamine molecule can be increased or decreased by scrolling the mouse wheel.

The information of the atoms, bonds, connectivity and coordinates included in the chemical structure of 4-Methyldiphenylamine can easily be identified by this visualization. By right-clicking the visualization screen, various other options are available including the visualization of van der Waals surface and exporting to a image file.


Additional Information for Identifying 4-Methyldiphenylamine Molecule

  • Other names (synonyms) or registry numbers of 4-Methyldiphenylamine

    The 4-Methyldiphenylamine compound may be called differently depending on the various different situations of industrial applications. Below are the list of the other names (synonyms) of 4-Methyldiphenylamine including the various registry numbers, if available:

    • 4-Methyldiphenylamine
    • 620-84-8
    • 4-methyl-N-phenylaniline
    • Benzenamine, 4-methyl-N-phenyl-
    • N-Phenyl-p-toluidine
    • 4-methyl-N-phenyl-aniline
    • 4-METHYL-N-PHENYLBENZAMINE
    • (4-methylphenyl)phenylamine
    • AE-641/05536041
    • W-105050
    • Phenyl-p-tolylamine
    • Phenyl-p-tolyl-amine
    • N-Pnenyl-4-methylaniline
    • HMS2337O21
    • N-(4-methylphenyl)-N-phenylamine
    • MFCD00092921
    • M1173
    • X4106
    • M-4117
    • M22700
    • A833571
    • C-07140
    • I01-5968

4-Methyldiphenylamine Identification Summary Frequently Asked Questions (FAQs)

  • What’s the chemical formula of 4-Methyldiphenylamine?

    C13H13N
  • How many atoms and what are the elements included the 4-Methyldiphenylamine molecule?

    27 atom(s) – 13 Hydrogen atom(s), 13 Carbon atom(s) and 1 Nitrogen atom(s)
  • How many chemical bonds and what kind of bonds are included the 4-Methyldiphenylamine structure?

    28 bond(s) – 15 non-H bond(s), 12 multiple bond(s), 2 rotatable bond(s), 12 aromatic bond(s), 2 six-membered ring(s) and 1 secondary amine(s) (aromatic)
  • What’s the 4-Methyldiphenylamine’s molecular weight?

    183.24902 g/mol
  • What’s the SMILES code of 4-Methyldiphenylamine?

    Cc2ccc(Nc1ccccc1)cc2
  • What’s the InChI string of 4-Methyldiphenylamine?

    InChI=1S/C13H13N/c1-11-7-9-13(10-8-11)14-12-5-3-2-4-6-12/h2-10,14H,1H3
  • What’s the InChIKey code of 4-Methyldiphenylamine?

    AGHYMXKKEXDUTA-UHFFFAOYSA-N

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