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Structure of 3-Ethylcyclohexanone (C8H14O)

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2D chemical structure image of 3-Ethylcyclohexanone
Chemical Formula C8H14O
Molecular Weight 126.19616 g/mol
IUPAC Name 3-ethylcyclohexan-1-one
SMILES String CCC1CCCC(=O)C1
InChI InChI=1S/C8H14O/c1-2-7-4-3-5-8(9)6-7/h7H,2-6H2,1H3
InChIKey IEVRHAUJJJBXFH-UHFFFAOYSA-N
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Chemical Structure Description

A chemical structure of a molecule includes the arrangement of atoms and the chemical bonds that hold the atoms together. The 3-Ethylcyclohexanone molecule contains a total of 23 bond(s). There are 9 non-H bond(s), 1 multiple bond(s), 1 rotatable bond(s), 1 double bond(s), 1 six-membered ring(s), and 1 ketone(s) (aliphatic). Images of the chemical structure of 3-Ethylcyclohexanone are given below:

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

The 2D chemical structure image of 3-Ethylcyclohexanone is also called skeletal formula, which is the standard notation for organic molecules. The carbon atoms in the chemical structure of 3-Ethylcyclohexanone 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 3-Ethylcyclohexanone 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 3-Ethylcyclohexanone. Download structure data file (SDF/MOL) file of this compound.


Interactive 3D Visualization

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

The 3-Ethylcyclohexanone 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 3-Ethylcyclohexanone 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 3-Ethylcyclohexanone 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 an image file.


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Input a chemical compound consisting of C, H, N, O, S, F, Cl, Br, I, Si, P, and/or As atom(s)

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  • Name: ethanol
  • CAS #: 64-17-5
  • Formula: C2H5OH
  • Smiles: CCO
  • InChI: InChI=1S/C2H6O/c1-2-3/h3H,2H2,1H3
  • InChIKey: LFQSCWFLJHTTHZ-UHFFFAOYSA-N

Additional Information for Identifying 3-Ethylcyclohexanone Molecule

  • Other names (synonyms) or registry numbers of 3-Ethylcyclohexanone

    The 3-Ethylcyclohexanone compound may be called differently depending on the various different situations of industrial applications. Below are the list of the other names (synonyms) of 3-Ethylcyclohexanone including the various registry numbers, if available:

    • BBV-38362480
    • AR-1F3178
    • 7677AD
    • 3-Ethylcyclohexanone #
    • Cyclohexanone, 3-ethyl-, (S)-
    • EN300-79320
    • 22461-89-8
    • Cyclohexanone, 3-ethyl-
    • 3-Ethylcyclohexanone

3-Ethylcyclohexanone Identification Summary Frequently Asked Questions (FAQs)

What’s the chemical formula of 3-Ethylcyclohexanone?
C8H14O
How many atoms and what are the elements included the 3-Ethylcyclohexanone molecule?
23 atom(s) - 14 Hydrogen atom(s), 8 Carbon atom(s), and 1 Oxygen atom(s)
How many chemical bonds and what kind of bonds are included the 3-Ethylcyclohexanone structure?
23 bond(s) - 9 non-H bond(s), 1 multiple bond(s), 1 rotatable bond(s), 1 double bond(s), 1 six-membered ring(s), and 1 ketone(s) (aliphatic)
What’s the 3-Ethylcyclohexanone’s molecular weight?
126.19616 g/mol
What’s the SMILES code of 3-Ethylcyclohexanone?
CCC1CCCC(=O)C1
What’s the InChI string of 3-Ethylcyclohexanone?
InChI=1S/C8H14O/c1-2-7-4-3-5-8(9)6-7/h7H,2-6H2,1H3
What’s the InChIKey code of 3-Ethylcyclohexanone?
IEVRHAUJJJBXFH-UHFFFAOYSA-N