Home Chemical Structure 2-Butylpyridine

Chemical Structure of 2-Butylpyridine (C9H13N)

Identification of 2-Butylpyridine Chemical Compound

2D chemical structure image of 2-Butylpyridine
Chemical Formula C9H13N
Molecular Weight 135.20622 g/mol
IUPAC Name 2-butylpyridine
SMILES String CCCCc1ccccn1
InChI InChI=1S/C9H13N/c1-2-3-6-9-7-4-5-8-10-9/h4-5,7-8H,2-3,6H2,1H3
InChIKey ADSOSINJPNKUJK-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 2-Butylpyridine molecule contains a total of 23 bond(s). There are 10 non-H bond(s), 6 multiple bond(s), 3 rotatable bond(s), 6 aromatic bond(s), 1 six-membered ring(s) and 1 Pyridine(s).
Images of the chemical structure of 2-Butylpyridine are given below:

2D chemical structure image of 2-Butylpyridine
2-dimensional (2D) chemical structure image of 2-Butylpyridine
3D chemical structure image of 2-Butylpyridine
3-dimensional (3D) chemical structure image of 2-Butylpyridine

The 2D chemical structure image of 2-Butylpyridine is also called skeletal formula, which is the standard notation for organic molecules. The carbon atoms in the chemical structure of 2-Butylpyridine 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 2-Butylpyridine 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 2-Butylpyridine.


An Interactive 3-dimensional (3D) Visualization of 2-Butylpyridine

For a better understanding of the chemical structure, an interactive 3D visualization of 2-Butylpyridine is provided here.

The 2-Butylpyridine 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 2-Butylpyridine 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 2-Butylpyridine 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 2-Butylpyridine Molecule

  • SMILES (Simplified Molecular-Input Line-Entry System) string of 2-Butylpyridine

    The SMILES string of 2-Butylpyridine is CCCCc1ccccn1, which can be can be imported by most molecule editors for conversion back into two-dimensional drawings or three-dimensional models of the 2-Butylpyridine.

  • Structure Data File (SDF/MOL File) of 2-Butylpyridine

    The structure data file (SDF/MOL File) of 2-Butylpyridine is available for download in the SDF page of 2-Butylpyridine, which provides the information about the atoms, bonds, connectivity and coordinates of 2-Butylpyridine. The 2-Butylpyridine structure data file can be imported to most of the cheminformatics software systems and applications.

  • Chemical formula of 2-Butylpyridine

    The molecular formula of 2-Butylpyridine is available in chemical formula page of 2-Butylpyridine, which identifies each constituent element by its chemical symbol and indicates the proportionate number of atoms of each element.

  • Molecular weight of 2-Butylpyridine

    The molecular weight of 2-Butylpyridine is available in molecular weight page of 2-Butylpyridine, 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 2-Butylpyridine

    The 2-Butylpyridine compound may be called differently depending on the various different situations of industrial applications. Below are the list of the other names (synonyms) of 2-Butylpyridine including the various registry numbers, if available:

    • 2-Butylpyridine
    • 5058-19-5
    • Pyridine, 2-butyl-
    • 2-Butyl-pyridine
    • W-105948
    • 2- Butylpyridine
    • 54XCM5F4F7
    • S413
    • I02-0414
    • J-514860
    • AR-1D9884

2-Butylpyridine Identification Summary Frequently Asked Questions (FAQs)

  • What’s the chemical formula of 2-Butylpyridine?

    C9H13N
  • How many atoms and what are the elements included the 2-Butylpyridine molecule?

    23 atom(s) – 13 Hydrogen atom(s), 9 Carbon atom(s) and 1 Nitrogen atom(s)
  • How many chemical bonds and what kind of bonds are included the 2-Butylpyridine structure?

    23 bond(s) – 10 non-H bond(s), 6 multiple bond(s), 3 rotatable bond(s), 6 aromatic bond(s), 1 six-membered ring(s) and 1 Pyridine(s)
  • What’s the 2-Butylpyridine’s molecular weight?

    135.20622 g/mol
  • What’s the SMILES code of 2-Butylpyridine?

    CCCCc1ccccn1
  • What’s the InChI string of 2-Butylpyridine?

    InChI=1S/C9H13N/c1-2-3-6-9-7-4-5-8-10-9/h4-5,7-8H,2-3,6H2,1H3
  • What’s the InChIKey code of 2-Butylpyridine?

    ADSOSINJPNKUJK-UHFFFAOYSA-N

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Source: Mol-Instincts Chemical Database, Predicted on Quantum.
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