SDF/Mol File of 2-METHYLBIPHENYL (C13H12)
Identification of 2-METHYLBIPHENYL Chemical Compound
|Molecular Weight||168.23438 g/mol|
Structure Data File (SDF/MOL File) Description
The structure data file (SDF/MOL File) of 2-METHYLBIPHENYL is available for download. Click the link below to start downloading.
The structure data file (SDF/MOL File) contains the information about the atoms, bonds, connectivity and coordinates of 2-METHYLBIPHENYL molecule. It starts with a header block, followed by "connection table“, which describes the structural relationships and properties of the atoms.
The structure data file (SDF/MOL File) available above can be imported to most of the chemistry-related software packages, performing further scientific analysis. Most of the computational software and visualization program require the structural information of the target molecule, and the above structure data file (SDF/MOL File) can be a good option.
Additional Information for Identifying 2-METHYLBIPHENYL Molecule
By visualizing the structure data file (SDF/MOL File) above, the chemical structure image of 2-METHYLBIPHENYL is available in chemical structure page of 2-METHYLBIPHENYL, which specifies the molecular geometry, i.e., the spatial arrangement of atoms and the chemical bonds that hold the atoms together.
The molecular weight of 2-METHYLBIPHENYL is available in molecular weight page of 2-METHYLBIPHENYL, which is calculated as the sum of the atomic masses of each constituent element multiplied by the number of atoms of that element.
The chemical formula of 2-METHYLBIPHENYL is given 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.
InChI (IUPAC International Chemical Identifier) information of 2-METHYLBIPHENYL
An alternative way of expressing structural information in text format is InChI. The full standard InChI of 2-METHYLBIPHENYL is:
It can provide a standard way to encode the molecular information of 2-METHYLBIPHENYL to facilitate the search for the compound information in databases and on the web.
The condensed, 27 character standard InChIKey (hashed version of the full standard InChI) of 2-METHYLBIPHENYL is:
The InChIKey may allow easier web searches for 2-METHYLBIPHENYL, but it needs to be linked to the full InChI to get back to the original structure of the 2-METHYLBIPHENYL since the full standard InChI cannot be reconstructed from the InChIKey.
Other names (synonyms) or registry numbers of 2-METHYLBIPHENYL
The 2-METHYLBIPHENYL compound may be named differently depending on the various situations of industrial applications. Other names (synonyms) of 2-METHYLBIPHENYL including the registry numbers are listed below, if available:
- Biphenyl, 2-methyl-
- 1,1'-Biphenyl, 2-methyl-
- 2-methyl biphenyl
- methyl 1,1' biphenyl
- 2-Phenyltoluene, 97%
- Biphenyl, 2-methyl- (8CI)
- 1,1'-Biphenyl, 2-methyl- (9CI)
2-METHYLBIPHENYL Identification Summary Frequently Asked Questions (FAQs)
|What’s the 2-METHYLBIPHENYL formula?|
|How many atoms and what elements are included in 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 in 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 molar mass?|
|What’s the SMILES structure of 2-METHYLBIPHENYL?|
|What’s the InChI code of 2-METHYLBIPHENYL?|
|What’s the InChIKey format of 2-METHYLBIPHENYL?|