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Structure & Deep Data of 2-Ethyl-3-methylbut-1-ene (C7H14)

Identification of 2-Ethyl-3-methylbut-1-ene Chemical Compound

2D chemical structure image of 2-Ethyl-3-methylbut-1-ene
Chemical Formula C7H14
Molecular Weight 98.18606 g/mol
IUPAC Name 2-methyl-3-methylidenepentane
SMILES String CCC(=C)C(C)C
InChI InChI=1S/C7H14/c1-5-7(4)6(2)3/h6H,4-5H2,1-3H3
InChIKey ADHCYQWFCLQBFG-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-Ethyl-3-methylbut-1-ene molecule contains a total of 20 bond(s). There are 6 non-H bond(s), 1 multiple bond(s), 2 rotatable bond(s), and 1 double bond(s). Images of the chemical structure of 2-Ethyl-3-methylbut-1-ene are given below:

2D chemical structure image of 2-Ethyl-3-methylbut-1-ene
2-dimensional (2D) chemical structure image of 2-Ethyl-3-methylbut-1-ene
3D chemical structure image of 2-Ethyl-3-methylbut-1-ene
3-dimensional (3D) chemical structure image of 2-Ethyl-3-methylbut-1-ene

The 2D chemical structure image of 2-Ethyl-3-methylbut-1-ene is also called skeletal formula, which is the standard notation for organic molecules. The carbon atoms in the chemical structure of 2-Ethyl-3-methylbut-1-ene 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-Ethyl-3-methylbut-1-ene 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-Ethyl-3-methylbut-1-ene. 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 2-Ethyl-3-methylbut-1-ene is provided here.

The 2-Ethyl-3-methylbut-1-ene 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-Ethyl-3-methylbut-1-ene 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-Ethyl-3-methylbut-1-ene 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
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Additional Information for Identifying 2-Ethyl-3-methylbut-1-ene Molecule

  • Other names (synonyms) or registry numbers of 2-Ethyl-3-methylbut-1-ene

    The 2-Ethyl-3-methylbut-1-ene 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-Ethyl-3-methylbut-1-ene including the various registry numbers, if available:

    • AR-1F4200
    • Pentane,2-methyl-3-methylene-
    • 2-ETHYL-3-METHYL-BUTENE
    • 1-Butene, 2-ethyl-3-methyl-
    • 3-Methyl-2-ethyl-1-butene
    • 7357-93-9
    • 2-Ethyl-3-methyl-1-butene
    • 2-Ethyl-3-methylbut-1-ene

2-Ethyl-3-methylbut-1-ene Identification Summary Frequently Asked Questions (FAQs)

What’s the chemical formula of 2-Ethyl-3-methylbut-1-ene?
C7H14
How many atoms and what are the elements included the 2-Ethyl-3-methylbut-1-ene molecule?
21 atom(s) - 14 Hydrogen atom(s) and 7 Carbon atom(s)
How many chemical bonds and what kind of bonds are included the 2-Ethyl-3-methylbut-1-ene structure?
20 bond(s) - 6 non-H bond(s), 1 multiple bond(s), 2 rotatable bond(s), and 1 double bond(s)
What’s the 2-Ethyl-3-methylbut-1-ene’s molecular weight?
98.18606 g/mol
What’s the SMILES code of 2-Ethyl-3-methylbut-1-ene?
CCC(=C)C(C)C
What’s the InChI string of 2-Ethyl-3-methylbut-1-ene?
InChI=1S/C7H14/c1-5-7(4)6(2)3/h6H,4-5H2,1-3H3
What’s the InChIKey code of 2-Ethyl-3-methylbut-1-ene?
ADHCYQWFCLQBFG-UHFFFAOYSA-N

5437 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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