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Structure & Deep Data of CYCLOHEXENE (C6H10)

Identification of CYCLOHEXENE Chemical Compound

2D chemical structure image of CYCLOHEXENE
Chemical Formula C6H10
Molecular Weight 82.1436 g/mol
IUPAC Name cyclohexene
SMILES String C1CCC=CC1
InChI InChI=1S/C6H10/c1-2-4-6-5-3-1/h1-2H,3-6H2
InChIKey HGCIXCUEYOPUTN-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 CYCLOHEXENE molecule contains a total of 16 bond(s). There are 6 non-H bond(s), 1 multiple bond(s), 1 double bond(s), and 1 six-membered ring(s). Images of the chemical structure of CYCLOHEXENE are given below:

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

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


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Interactive 3D Visualization

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

The CYCLOHEXENE 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 CYCLOHEXENE 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 CYCLOHEXENE 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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  • CAS #: 64-17-5
  • Formula: C2H5OH
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  • InChIKey: LFQSCWFLJHTTHZ-UHFFFAOYSA-N

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Additional Information for Identifying CYCLOHEXENE Molecule

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

    The SMILES string of CYCLOHEXENE is C1CCC=CC1, which can be can be imported by most molecule editors for conversion back into two-dimensional drawings or three-dimensional models of the CYCLOHEXENE.

  • Structure Data File (SDF/MOL File) of CYCLOHEXENE

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

  • Chemical formula of CYCLOHEXENE

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

  • Molecular weight of CYCLOHEXENE

    The molecular weight of CYCLOHEXENE is available in molecular weight page of CYCLOHEXENE, 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 CYCLOHEXENE

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

    • BBV-75779069
    • 33004-06-7
    • Cyclohexene, contains 100 ppm BHT as inhibitor, >=99.0%
    • Z1262252892
    • F0001-0225
    • S14-1475
    • J-002481
    • Cyclohexene, inhibitor-free, ReagentPlus(R), 99%
    • A802251
    • Cyclohexene [UN2256] [Flammable liquid]
    • Cyclohexene [UN2256] [Flammable liquid]
    • 15650-80-3
    • RTR-002196
    • MFCD00001539
    • ANW-16200
    • 7450AF
    • LTBB001107
    • Cyclohexene, analytical standard
    • 12L0P8F7GN
    • Cyclohexene, 99% 100ml
    • Cyclohexane-1beta,2alpha-diyl
    • 1,3,4-Tetrahydrobenzene
    • 3-Cyclohexenyl radical
    • (Z)-Cyclohexene
    • (e)-cyclohexene
    • 2-cyclohexen
    • cyclohexane N
    • cyclo-hexene
    • cyclo hexene
    • 4-Cyclohexenyl radical
    • CYCLOHEXENE-D10, 98 ATOM % D
    • 7493-04-1
    • UN 2256
    • cyclohexen
    • Zyklohexen
    • Cykloheksen [Polish]
    • 3,4,5,6-Tetrahydrobenzene
    • Benzene, tetrahydro-
    • Cykloheksen
    • 1-Cyclohexene
    • Hexanaphthylene
    • Benzenetetrahydride
    • 1,2,3,4-Tetrahydrobenzene
    • Benzene tetrahydride
    • Cyclohex-1-ene
    • Tetrahydrobenzene
    • 110-83-8

CYCLOHEXENE Identification Summary Frequently Asked Questions (FAQs)

What’s the chemical formula of CYCLOHEXENE?
C6H10
How many atoms and what are the elements included the CYCLOHEXENE molecule?
16 atom(s) - 10 Hydrogen atom(s) and 6 Carbon atom(s)
How many chemical bonds and what kind of bonds are included the CYCLOHEXENE structure?
16 bond(s) - 6 non-H bond(s), 1 multiple bond(s), 1 double bond(s), and 1 six-membered ring(s)
What’s the CYCLOHEXENE’s molecular weight?
82.1436 g/mol
What’s the SMILES code of CYCLOHEXENE?
C1CCC=CC1
What’s the InChI string of CYCLOHEXENE?
InChI=1S/C6H10/c1-2-4-6-5-3-1/h1-2H,3-6H2
What’s the InChIKey code of CYCLOHEXENE?
HGCIXCUEYOPUTN-UHFFFAOYSA-N

19713 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).

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