SDF/Mol File of Chloro(chloromethyl)bis[4-(trifluoromethyl)phenyl]silane (C15H10Cl2F6Si)
Identification of Chloro(chloromethyl)bis[4-(trifluoromethyl)phenyl]silane Chemical Compound
![2D chemical structure image of chloro(chloromethyl)bis[4-(trifluoromethyl)phenyl]silane](http://static.molinstincts.com/compound_common/chloro-chloromethyl-bis-4-trifluoromethyl-phenyl-silane-2D-structure-CT1000003239.png)
| Chemical Formula | C15H10Cl2F6Si |
|---|---|
| Molecular Weight | 403.22122 g/mol |
| IUPAC Name | chloro(chloromethyl)bis[4-(trifluoromethyl)phenyl]silane |
| SMILES String | FC(F)(F)c1ccc(cc1)[Si](Cl)(CCl)c2ccc(cc2)C(F)(F)F |
| InChI | InChI=1S/C15H10Cl2F6Si/c16-9-24(17,12-5-1-10(2-6-12)14(18,19)20)13-7-3-11(4-8-13)15(21,22)23/h1-8H,9H2 |
| InChIKey | NLKDYADJEBOLOR-UHFFFAOYSA-N |
Structure Data File (SDF/MOL File) Description
The structure data file (SDF/MOL File) of chloro(chloromethyl)bis[4-(trifluoromethyl)phenyl]silane is available for download. Click the link below to start downloading.
Download structure data file (SDF/MOL File)
The structure data file (SDF/MOL File) contains the information about the atoms, bonds, connectivity and coordinates of chloro(chloromethyl)bis[4-(trifluoromethyl)phenyl]silane 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.
![3D chemical structure image of chloro(chloromethyl)bis[4-(trifluoromethyl)phenyl]silane](http://static.molinstincts.com/compound_3d/chloro-chloromethyl-bis-4-trifluoromethyl-phenyl-silane-3D-structure-CT1000003239.png)
chemical table area
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- InChIKey: LFQSCWFLJHTTHZ-UHFFFAOYSA-N
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Additional Information for Identifying Chloro(chloromethyl)bis[4-(trifluoromethyl)phenyl]silane Molecule
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Chemical structure of chloro(chloromethyl)bis[4-(trifluoromethyl)phenyl]silane
By visualizing the structure data file (SDF/MOL File) above, the chemical structure image of chloro(chloromethyl)bis[4-(trifluoromethyl)phenyl]silane is available in chemical structure page of chloro(chloromethyl)bis[4-(trifluoromethyl)phenyl]silane, which specifies the molecular geometry, i.e., the spatial arrangement of atoms and the chemical bonds that hold the atoms together.
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Molecular weight of chloro(chloromethyl)bis[4-(trifluoromethyl)phenyl]silane
The molecular weight of chloro(chloromethyl)bis[4-(trifluoromethyl)phenyl]silane is available in molecular weight page of chloro(chloromethyl)bis[4-(trifluoromethyl)phenyl]silane, which is calculated as the sum of the atomic masses of each constituent element multiplied by the number of atoms of that element.
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Chemical formula of chloro(chloromethyl)bis[4-(trifluoromethyl)phenyl]silane
The chemical formula of chloro(chloromethyl)bis[4-(trifluoromethyl)phenyl]silane is given in chemical formula page of chloro(chloromethyl)bis[4-(trifluoromethyl)phenyl]silane, which identifies each constituent element by its chemical symbol and indicates the proportionate number of atoms of each element.
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InChI (IUPAC International Chemical Identifier) information of chloro(chloromethyl)bis[4-(trifluoromethyl)phenyl]silane
An alternative way of expressing structural information in text format is InChI. The full standard InChI of chloro(chloromethyl)bis[4-(trifluoromethyl)phenyl]silane is:
InChI=1S/C15H10Cl2F6Si/c16-9-24(17,12-5-1-10(2-6-12)14(18,19)20)13-7-3-11(4-8-13)15(21,22)23/h1-8H,9H2
It can provide a standard way to encode the molecular information of chloro(chloromethyl)bis[4-(trifluoromethyl)phenyl]silane 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 chloro(chloromethyl)bis[4-(trifluoromethyl)phenyl]silane is:
InChIKey=NLKDYADJEBOLOR-UHFFFAOYSA-N
The InChIKey may allow easier web searches for chloro(chloromethyl)bis[4-(trifluoromethyl)phenyl]silane, but it needs to be linked to the full InChI to get back to the original structure of the chloro(chloromethyl)bis[4-(trifluoromethyl)phenyl]silane since the full standard InChI cannot be reconstructed from the InChIKey.
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Other names (synonyms) or registry numbers of chloro(chloromethyl)bis[4-(trifluoromethyl)phenyl]silane
The chloro(chloromethyl)bis[4-(trifluoromethyl)phenyl]silane compound may be named differently depending on the various situations of industrial applications. Other names (synonyms) of chloro(chloromethyl)bis[4-(trifluoromethyl)phenyl]silane including the registry numbers are listed below, if available:
None available.
Chloro(chloromethyl)bis[4-(trifluoromethyl)phenyl]silane Identification Summary Frequently Asked Questions (FAQs)
| What’s the chloro(chloromethyl)bis[4-(trifluoromethyl)phenyl]silane formula? |
|---|
| C15H10Cl2F6Si |
| How many atoms and what elements are included in the chloro(chloromethyl)bis[4-(trifluoromethyl)phenyl]silane molecule? |
| 34 atom(s) - 10 Hydrogen atom(s), 15 Carbon atom(s), 6 Fluorine atom(s), and 2 Chlorine atom(s) |
| How many chemical bonds and what kind of bonds are in the chloro(chloromethyl)bis[4-(trifluoromethyl)phenyl]silane structure? |
| 35 bond(s) - 25 non-H bond(s), 12 multiple bond(s), 2 rotatable bond(s), 12 aromatic bond(s), and 2 six-membered ring(s) |
| What’s the chloro(chloromethyl)bis[4-(trifluoromethyl)phenyl]silane’s molar mass? |
| 403.22122 g/mol |
| What’s the SMILES structure of chloro(chloromethyl)bis[4-(trifluoromethyl)phenyl]silane? |
| FC(F)(F)c1ccc(cc1)[Si](Cl)(CCl)c2ccc(cc2)C(F)(F)F |
| What’s the InChI code of chloro(chloromethyl)bis[4-(trifluoromethyl)phenyl]silane? |
| InChI=1S/C15H10Cl2F6Si/c16-9-24(17,12-5-1-10(2-6-12)14(18,19)20)13-7-3-11(4-8-13)15(21,22)23/h1-8H,9H2 |
| What’s the InChIKey format of chloro(chloromethyl)bis[4-(trifluoromethyl)phenyl]silane? |
| NLKDYADJEBOLOR-UHFFFAOYSA-N |
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commercialized into Mol-Instincts database and ChemRTP, ChemEssen, Inc (2024).