Download Structure Data File(SDF/Mol File) of Trans-2-dodecene (C12H24)
Identification of Trans-2-dodecene Chemical Compound
|Molecular Weight||168.31896 g/mol|
Structure Data File (SDF/MOL File) Description
The structure data file (SDF/MOL File) of trans-2-dodecene 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 trans-2-dodecene 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 Trans-2-dodecene Molecule
By visualizing the structure data file (SDF/MOL File) above, the chemical structure image of trans-2-dodecene is available in chemical structure page of trans-2-dodecene, 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 trans-2-dodecene is available in molecular weight page of trans-2-dodecene, 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 trans-2-dodecene is given in chemical formula page of trans-2-dodecene, 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 trans-2-dodecene
An alternative way of expressing structural information in text format is InChI. The full standard InChI of trans-2-dodecene is:
It can provide a standard way to encode the molecular information of trans-2-dodecene 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 trans-2-dodecene is:
The InChIKey may allow easier web searches for trans-2-dodecene, but it needs to be linked to the full InChI to get back to the original structure of the trans-2-dodecene since the full standard InChI cannot be reconstructed from the InChIKey.
Other names (synonyms) or registry numbers of trans-2-dodecene
The trans-2-dodecene compound may be named differently depending on the various situations of industrial applications. Other names (synonyms) of trans-2-dodecene including the registry numbers are listed below, if available:
- 2-Dodecene, (E)-
- 2-Dodecene, trans-
- Alkenes, C10-16
- 2-Dodecene, (E)-
Trans-2-dodecene Identification Summary Frequently Asked Questions (FAQs)
What’s the trans-2-dodecene formula?C12H24
How many atoms and what elements are included in the trans-2-dodecene molecule?36 atom(s) – 24 Hydrogen atom(s) and 12 Carbon atom(s)
How many chemical bonds and what kind of bonds are in the trans-2-dodecene structure?35 bond(s) – 11 non-H bond(s), 1 multiple bond(s), 8 rotatable bond(s) and 1 double bond(s)
What’s the trans-2-dodecene’s molar mass?168.31896 g/mol
What’s the SMILES structure of trans-2-dodecene?CCCCCCCCCC=CC
What’s the InChI code of trans-2-dodecene?InChI=1S/C12H24/c1-3-5-7-9-11-12-10-8-6-4-2/h3,5H,4,6-12H2,1-2H3/b5-3+
What’s the InChIKey format of trans-2-dodecene?ADOQBZAVKYCFOI-HWKANZROSA-N