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Structure of Lunularin (C14H14O2)

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2D chemical structure image of Lunularin
Chemical Formula C14H14O2
Molecular Weight 214.25976 g/mol
IUPAC Name 3-[2-(4-hydroxyphenyl)ethyl]phenol
SMILES String Oc2ccc(CCc1cccc(O)c1)cc2
InChI InChI=1S/C14H14O2/c15-13-8-6-11(7-9-13)4-5-12-2-1-3-14(16)10-12/h1-3,6-10,15-16H,4-5H2
InChIKey ILEYXPCRQKRNIJ-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 Lunularin molecule contains a total of 31 bond(s). There are 17 non-H bond(s), 12 multiple bond(s), 3 rotatable bond(s), 12 aromatic bond(s), 2 six-membered ring(s), and 2 aromatic hydroxyl(s). Images of the chemical structure of Lunularin are given below:

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

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

The Lunularin 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 Lunularin 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 Lunularin 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)

Input example for Ethanol:

  • 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 Lunularin Molecule

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

    The SMILES string of Lunularin is Oc2ccc(CCc1cccc(O)c1)cc2, which can be can be imported by most molecule editors for conversion back into two-dimensional drawings or three-dimensional models of the Lunularin.

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

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

  • Chemical formula of Lunularin

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

  • Molecular weight of Lunularin

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

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

    • 1-(4-Hydroxyphenyl)-2-(3-hydroxyphenyl)ethane
    • LMPK13090039
    • 3,4'-(ethane-1,2-diyl)diphenol
    • 3-(4-Hydroxyphenethyl)phenol
    • 3,4'-Ethylenebisphenol
    • 37116-80-6
    • Lunularin

Lunularin Identification Summary Frequently Asked Questions (FAQs)

What’s the chemical formula of Lunularin?
C14H14O2
How many atoms and what are the elements included the Lunularin molecule?
30 atom(s) - 14 Hydrogen atom(s), 14 Carbon atom(s), and 2 Oxygen atom(s)
How many chemical bonds and what kind of bonds are included the Lunularin structure?
31 bond(s) - 17 non-H bond(s), 12 multiple bond(s), 3 rotatable bond(s), 12 aromatic bond(s), 2 six-membered ring(s), and 2 aromatic hydroxyl(s)
What’s the Lunularin’s molecular weight?
214.25976 g/mol
What’s the SMILES code of Lunularin?
Oc2ccc(CCc1cccc(O)c1)cc2
What’s the InChI string of Lunularin?
InChI=1S/C14H14O2/c15-13-8-6-11(7-9-13)4-5-12-2-1-3-14(16)10-12/h1-3,6-10,15-16H,4-5H2
What’s the InChIKey code of Lunularin?
ILEYXPCRQKRNIJ-UHFFFAOYSA-N