Home Structure 2-benzyl-1,3,4-oxadiazole

Structure of 2-benzyl-1,3,4-oxadiazole (C9H8N2O)

Identification of 2-benzyl-1,3,4-oxadiazole Chemical Compound

2D chemical structure image of 2-benzyl-1,3,4-oxadiazole
Chemical Formula C9H8N2O
Molecular Weight 160.17262 g/mol
IUPAC Name 2-benzyl-1,3,4-oxadiazole
SMILES String C(c1ccccc1)c2nnco2
InChI InChI=1S/C9H8N2O/c1-2-4-8(5-3-1)6-9-11-10-7-12-9/h1-5,7H,6H2
InChIKey QBXCAUWVKMECDN-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-benzyl-1,3,4-oxadiazole molecule contains a total of 21 bond(s) There are 13 non-H bond(s), 11 multiple bond(s), 2 rotatable bond(s), 11 aromatic bond(s), 1 five-membered ring(s) and 1 six-membered ring(s).
Images of the chemical structure of 2-benzyl-1,3,4-oxadiazole are given below:

2D chemical structure image of 2-benzyl-1,3,4-oxadiazole
2-dimensional (2D) chemical structure image of 2-benzyl-1,3,4-oxadiazole
3D chemical structure image of 2-benzyl-1,3,4-oxadiazole
3-dimensional (3D) chemical structure image of 2-benzyl-1,3,4-oxadiazole

The 2D chemical structure image of 2-benzyl-1,3,4-oxadiazole is also called skeletal formula, which is the standard notation for organic molecules. The carbon atoms in the chemical structure of 2-benzyl-1,3,4-oxadiazole 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-benzyl-1,3,4-oxadiazole 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-benzyl-1,3,4-oxadiazole.


An Interactive 3-dimensional (3D) Visualization of 2-benzyl-1,3,4-oxadiazole

For a better understanding of the chemical structure, an interactive 3D visualization of 2-benzyl-1,3,4-oxadiazole is provided here.

The 2-benzyl-1,3,4-oxadiazole 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-benzyl-1,3,4-oxadiazole 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-benzyl-1,3,4-oxadiazole 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.





More Properties of 2-benzyl-1,3,4-oxadiazole

For physicochemical, thermodynamic, transport, spectra, and other property data & information, the followings are available from “Mol-Instincts”, a chemical database based on quantum mechanics:







Additional Information for Identifying 2-benzyl-1,3,4-oxadiazole Molecule

  • Other names (synonyms) or registry numbers of 2-benzyl-1,3,4-oxadiazole

    The 2-benzyl-1,3,4-oxadiazole 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-benzyl-1,3,4-oxadiazole including the various registry numbers, if available:

    • I14-10259
    • A15196
    • 2-Benzyl-[1,3,4]oxadiazole
    • 13148-63-5

Additional Outstanding Products

2-benzyl-1,3,4-oxadiazole Identification Summary Frequently Asked Questions (FAQs)

What’s the chemical formula of 2-benzyl-1,3,4-oxadiazole?
C9H8N2O
How many atoms and what are the elements included the 2-benzyl-1,3,4-oxadiazole molecule?
20 atom(s) - 8 Hydrogen atom(s), 9 Carbon atom(s), 2 Nitrogen atom(s) and 1 Oxygen atom(s)
How many chemical bonds and what kind of bonds are included the 2-benzyl-1,3,4-oxadiazole structure?
21 bond(s) - 13 non-H bond(s), 11 multiple bond(s), 2 rotatable bond(s), 11 aromatic bond(s), 1 five-membered ring(s) and 1 six-membered ring(s)
What’s the 2-benzyl-1,3,4-oxadiazole’s molecular weight?
160.17262 g/mol
What’s the SMILES code of 2-benzyl-1,3,4-oxadiazole?
C(c1ccccc1)c2nnco2
What’s the InChI string of 2-benzyl-1,3,4-oxadiazole?
InChI=1S/C9H8N2O/c1-2-4-8(5-3-1)6-9-11-10-7-12-9/h1-5,7H,6H2
What’s the InChIKey code of 2-benzyl-1,3,4-oxadiazole?
QBXCAUWVKMECDN-UHFFFAOYSA-N

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