Structure & Deep Data of P-Toluidine (C7H9N)

Chemical Structure Description

A chemical structure of a molecule includes the arrangement of atoms and the chemical bonds that hold the atoms together. The p-Toluidine molecule contains a total of 17 bond(s). There are 8 non-H bond(s), 6 multiple bond(s), 6 aromatic bond(s), 1 six-membered ring(s), and 1 primary amine(s) (aromatic). Images of the chemical structure of p-Toluidine are given below:

The 2D chemical structure image of p-Toluidine is also called skeletal formula, which is the standard notation for organic molecules. The carbon atoms in the chemical structure of p-Toluidine 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 p-Toluidine 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 p-Toluidine. Download structure data file (SDF/MOL) file of this compound.

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Additional Information for Identifying P-Toluidine Molecule

• SMILES (Simplified Molecular-Input Line-Entry System) string of p-Toluidine

  The SMILES string of p-Toluidine is Cc1ccc(N)cc1, which can be can be imported by most molecule editors for conversion back into two-dimensional drawings or three-dimensional models of the p-Toluidine.

• Structure Data File (SDF/MOL File) of p-Toluidine

  The structure data file (SDF/MOL File) of p-Toluidine is available for download in the SDF page of p-Toluidine, which provides the information about the atoms, bonds, connectivity and coordinates of p-Toluidine. The p-Toluidine structure data file can be imported to most of the cheminformatics software systems and applications.

• Chemical formula of p-Toluidine

  The molecular formula of p-Toluidine is available in chemical formula page of p-Toluidine, which identifies each constituent element by its chemical symbol and indicates the proportionate number of atoms of each element.

• Molecular weight of p-Toluidine

  The molecular weight of p-Toluidine is available in molecular weight page of p-Toluidine, which is calculated as the sum of the atomic weights of each constituent element multiplied by the number of atoms of that element in the molecular formula.

• Other names (synonyms) or registry numbers of p-Toluidine

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

  • T6075853
  • EN300-17941
  • BBV-38789983
  • AR-1L2546
  • 4MN
  • 12221-03-3
  • p-Toluidine, for spectrophotometric det. of Au, Tl(III), W, >=99.0%
  • P-TOLUIDINE, United States Pharmacopeia (USP) Reference Standard
  • F2190-0420
  • p-Toluidine, liquid or solid [UN1708] [Poison]

  • J-001600
  • I01-6358
  • p-Toluidine, liquid or solid [UN1708] [Poison]
  • AZ0001-0112
  • p-Toluidine, SAJ special grade, >=99.0%
  • AZOIC COUPLING COMPONENT 107
  • MFCD00007906
  • BDBM50008562
  • ANW-15355
  • METHYL, (4-AMINOPHENYL)-

  • p-Toluidine, for synthesis, 99%
  • 32954-54-4 (nitrate)
  • 4-Aminotoluene; 4-Methylaniline
  • Jsp000585
  • 540-23-8 (hydrochloride)
  • p-Toluidine, liquid or solid
  • I1D0KL7I4U
  • p-Toluidine, 99.6%
  • 4-Methyl-1-aminobenzene
  • p-Toluidine, 99%

  • 4-Methyl-benzenamine
  • 4-methyl-phenylamine
  • 4-methyl-aniline
  • 4-methyl aniline
  • para-methylaniline
  • 4-aminotoluene;
  • 4-amino-toluene
  • 4-tolylamine
  • 4methylaniline
  • Benzenamine, 4-methyl-, hydrochloride (1:1)

  • paratoluidine
  • Benzenamine, ar-methyl-
  • CAS-106-49-0
  • p-Toluidyna
  • para-toluidine
  • 26915-12-8
  • CI 37107
  • RCRA waste no. U353
  • 4-Methylcyclohexyl amine
  • CI Azoic Coupling Component 107

  • 4-methylphenylamine
  • C.I. 37107
  • p-tolyl-amine
  • 4-Aminotoluen [Czech]
  • p-Toluidyna [Polish]
  • C.I. Azoic Coupling Component 107
  • p-Toluidin [Czech]
  • RCRA waste number U353
  • Toluidine, p-
  • 4-Amino-1-methylbenzene

  • 4-Aminotoluen
  • Aniline, p-methyl-
  • Naphtol AS-KGLL
  • Naphtol AS-KG
  • 1-Amino-4-methylbenzene
  • p-Aminotoluene
  • p-Toluidin
  • p-Methylbenzenamine
  • p-Methylaniline
  • 4-Methylbenzenamine

  • Benzenamine, 4-methyl-
  • 4-AMINOTOLUENE
  • p-Tolylamine
  • 4-Toluidine
  • 106-49-0
  • p-Toluidine

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P-Toluidine Identification Summary Frequently Asked Questions (FAQs)

What’s the chemical formula of p-Toluidine?
C7H9N
How many atoms and what are the elements included the p-Toluidine molecule?
17 atom(s) - 9 Hydrogen atom(s), 7 Carbon atom(s), and 1 Nitrogen atom(s)
How many chemical bonds and what kind of bonds are included the p-Toluidine structure?
17 bond(s) - 8 non-H bond(s), 6 multiple bond(s), 6 aromatic bond(s), 1 six-membered ring(s), and 1 primary amine(s) (aromatic)
What’s the p-Toluidine’s molecular weight?
107.15306 g/mol
What’s the SMILES code of p-Toluidine?
Cc1ccc(N)cc1
What’s the InChI string of p-Toluidine?
InChI=1S/C7H9N/c1-6-2-4-7(8)5-3-6/h2-5H,8H2,1H3
What’s the InChIKey code of p-Toluidine?
RZXMPPFPUUCRFN-UHFFFAOYSA-N

3239 The contents of this page can freely be shared if cited as follows:
Source: Chemical Compounds Deep Data Source (CCDDS; https://www.molinstincts.com) based on 41 patented QSQN and QN technology
commercialized into Mol-Instincts database and ChemRTP, ChemEssen, Inc (2024).