Home Chemical Structure 2-METHYLBIPHENYL

Chemical Structure of 2-METHYLBIPHENYL (C13H12)

Identification of 2-METHYLBIPHENYL Chemical Compound

2D chemical structure image of 2-METHYLBIPHENYL
Chemical Formula C13H12
Molecular Weight 168.23438 g/mol
IUPAC Name 1-methyl-2-phenylbenzene
SMILES String Cc1ccccc1c2ccccc2
InChI InChI=1S/C13H12/c1-11-7-5-6-10-13(11)12-8-3-2-4-9-12/h2-10H,1H3
InChIKey ALLIZEAXNXSFGD-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-METHYLBIPHENYL molecule contains a total of 26 bond(s). There are 14 non-H bond(s), 12 multiple bond(s), 1 rotatable bond(s), 12 aromatic bond(s) and 2 six-membered ring(s).
Images of the chemical structure of 2-METHYLBIPHENYL are given below:

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

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


An Interactive 3-dimensional (3D) Visualization of 2-METHYLBIPHENYL

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

The 2-METHYLBIPHENYL 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-METHYLBIPHENYL 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-METHYLBIPHENYL 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-METHYLBIPHENYL Molecule

  • SMILES (Simplified Molecular-Input Line-Entry System) string of 2-METHYLBIPHENYL

    The SMILES string of 2-METHYLBIPHENYL is Cc1ccccc1c2ccccc2, which can be can be imported by most molecule editors for conversion back into two-dimensional drawings or three-dimensional models of the 2-METHYLBIPHENYL.

  • Structure Data File (SDF/MOL File) of 2-METHYLBIPHENYL

    The structure data file (SDF/MOL File) of 2-METHYLBIPHENYL is available for download in the SDF page of 2-METHYLBIPHENYL, which provides the information about the atoms, bonds, connectivity and coordinates of 2-METHYLBIPHENYL. The 2-METHYLBIPHENYL structure data file can be imported to most of the cheminformatics software systems and applications.

  • Chemical formula of 2-METHYLBIPHENYL

    The molecular formula of 2-METHYLBIPHENYL is available in chemical formula page of 2-METHYLBIPHENYL, which identifies each constituent element by its chemical symbol and indicates the proportionate number of atoms of each element.

  • Molecular weight of 2-METHYLBIPHENYL

    The molecular weight of 2-METHYLBIPHENYL is available in molecular weight page of 2-METHYLBIPHENYL, 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 2-METHYLBIPHENYL

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

    • 2-METHYLBIPHENYL
    • 643-58-3
    • 2-Methyl-1,1'-biphenyl
    • 1-Methyl-2-phenylbenzene
    • 2-Phenyltoluene
    • o-Phenyltoluene
    • o-Methylbiphenyl
    • Biphenyl, 2-methyl-
    • 1,1'-Biphenyl, 2-methyl-
    • 2-methyl biphenyl
    • 2-Methyl-biphenyl
    • 1-methyl-2-phenyl-benzene
    • W-104848
    • 648-53-3
    • methyl 1,1' biphenyl
    • 2-Phenyltoluene, 97%
    • Biphenyl, 2-methyl- (8CI)
    • X937MQ8S1T
    • ANW-34854
    • MFCD00008517
    • 1,1'-Biphenyl, 2-methyl- (9CI)
    • H220
    • M1242
    • A834729
    • C-36451
    • S01-0364
    • 3B1-007019

2-METHYLBIPHENYL Identification Summary Frequently Asked Questions (FAQs)

What’s the chemical formula of 2-METHYLBIPHENYL?
C13H12
How many atoms and what are the elements included the 2-METHYLBIPHENYL molecule?
25 atom(s) – 12 Hydrogen atom(s) and 13 Carbon atom(s)
How many chemical bonds and what kind of bonds are included the 2-METHYLBIPHENYL structure?
26 bond(s) – 14 non-H bond(s), 12 multiple bond(s), 1 rotatable bond(s), 12 aromatic bond(s) and 2 six-membered ring(s)
What’s the 2-METHYLBIPHENYL’s molecular weight?
168.23438 g/mol
What’s the SMILES code of 2-METHYLBIPHENYL?
Cc1ccccc1c2ccccc2
What’s the InChI string of 2-METHYLBIPHENYL?
InChI=1S/C13H12/c1-11-7-5-6-10-13(11)12-8-3-2-4-9-12/h2-10H,1H3
What’s the InChIKey code of 2-METHYLBIPHENYL?
ALLIZEAXNXSFGD-UHFFFAOYSA-N

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