Home Structure 2-METHYL-2-HEPTANOL

Structure of 2-METHYL-2-HEPTANOL (C8H18O)

Identification of 2-METHYL-2-HEPTANOL Chemical Compound

2D chemical structure image of 2-METHYL-2-HEPTANOL
Chemical Formula C8H18O
Molecular Weight 130.22792 g/mol
IUPAC Name 2-methylheptan-2-ol
SMILES String CCCCCC(C)(C)O
InChI InChI=1S/C8H18O/c1-4-5-6-7-8(2,3)9/h9H,4-7H2,1-3H3
InChIKey ACBMYYVZWKYLIP-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-METHYL-2-HEPTANOL molecule contains a total of 26 bond(s). There are 8 non-H bond(s), 4 rotatable bond(s), 1 hydroxyl group(s) and 1 tertiary alcohol(s).
Images of the chemical structure of 2-METHYL-2-HEPTANOL are given below:

2D chemical structure image of 2-METHYL-2-HEPTANOL
2-dimensional (2D) chemical structure image of 2-METHYL-2-HEPTANOL
3D chemical structure image of 2-METHYL-2-HEPTANOL
3-dimensional (3D) chemical structure image of 2-METHYL-2-HEPTANOL

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


An Interactive 3-dimensional (3D) Visualization of 2-METHYL-2-HEPTANOL

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

The 2-METHYL-2-HEPTANOL 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-METHYL-2-HEPTANOL 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-METHYL-2-HEPTANOL 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-METHYL-2-HEPTANOL Molecule

  • Other names (synonyms) or registry numbers of 2-METHYL-2-HEPTANOL

    The 2-METHYL-2-HEPTANOL 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-METHYL-2-HEPTANOL including the various registry numbers, if available:

    • 2-METHYL-2-HEPTANOL
    • 2-Methylheptan-2-ol
    • 2-Heptanol, 2-methyl-
    • 625-25-2
    • 2-hydroxy-2-methyl-heptane
    • 1,1-DIMETHYLHEXANOL
    • 1,1-DIMETHYLHEXANOL-1
    • 7992AF
    • ANW-34240
    • MFCD00021845
    • M0771

2-METHYL-2-HEPTANOL Identification Summary Frequently Asked Questions (FAQs)

What’s the chemical formula of 2-METHYL-2-HEPTANOL?
C8H18O
How many atoms and what are the elements included the 2-METHYL-2-HEPTANOL molecule?
27 atom(s) - 18 Hydrogen atom(s), 8 Carbon atom(s) and 1 Oxygen atom(s)
How many chemical bonds and what kind of bonds are included the 2-METHYL-2-HEPTANOL structure?
26 bond(s) - 8 non-H bond(s), 4 rotatable bond(s), 1 hydroxyl group(s) and 1 tertiary alcohol(s)
What’s the 2-METHYL-2-HEPTANOL’s molecular weight?
130.22792 g/mol
What’s the SMILES code of 2-METHYL-2-HEPTANOL?
CCCCCC(C)(C)O
What’s the InChI string of 2-METHYL-2-HEPTANOL?
InChI=1S/C8H18O/c1-4-5-6-7-8(2,3)9/h9H,4-7H2,1-3H3
What’s the InChIKey code of 2-METHYL-2-HEPTANOL?
ACBMYYVZWKYLIP-UHFFFAOYSA-N

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