Molecular Weight of Trityl-PEG8-azide (C35H47N3O8)
Identification of Trityl-PEG8-azide Chemical Compound
| Chemical Formula | C35H47N3O8 |
|---|---|
| Molecular Weight | 637.76298 g/mol |
| IUPAC Name | 25-azido-1,1,1-triphenyl-2,5,8,11,14,17,20,23-octaoxapentacosane |
| SMILES String | [N-]=[N+]=NCCOCCOCCOCCOCCOCCOCCOCCOC(c1ccccc1)(c2ccccc2)c3ccccc3 |
| InChI | InChI=1S/C35H47N3O8/c36-38-37-16-17-39-18-19-40-20-21-41-22-23-42-24-25-43-26-27-44-28-29-45-30-31-46-35(32-10-4-1-5-11-32,33-12-6-2-7-13-33)34-14-8-3-9-15-34/h1-15H,16-31H2 |
| InChIKey | GMEFSMLZCBKWDL-UHFFFAOYSA-N |
Molecular Weight Description
The Trityl-PEG8-azide molecule consists of 47 Hydrogen atom(s), 35 Carbon atom(s), 3 Nitrogen atom(s), and 8 Oxygen atom(s) - a total of 93 atom(s). The molecular weight of Trityl-PEG8-azide is determined by the sum of the atomic weights of each constituent element multiplied by the number of atoms, which is calculated to be:
$$ 637.76298 · \frac{g}{mol} $$
The exact term of the above molecular weight is “molar mass”, which is based on the atomic mass of each element. Molecular weight is actually an older term of “relative molar mass” or “molecular mass”, which is a dimensionless quantity equal to the molar mass divided by the molar mass constant defined by 1 g/mol.
Molecular masses are calculated from the standard atomic weights of each nuclide, while molar masses are calculated from the atomic mass of each element. The atomic mass takes into account the isotopic distribution of the element in a given sample.
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- CAS #: 64-17-5
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- InChI: InChI=1S/C2H6O/c1-2-3/h3H,2H2,1H3
- InChIKey: LFQSCWFLJHTTHZ-UHFFFAOYSA-N
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Additional Information for Identifying Trityl-PEG8-azide Molecule
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Structure Data File (SDF/MOL File) of Trityl-PEG8-azide
The structure data file (SDF/MOL File) of Trityl-PEG8-azide is available for download in the SDF page of Trityl-PEG8-azide, which provides the information on atoms, bonds, connectivity and coordinates of Trityl-PEG8-azide. The Trityl-PEG8-azide structure data file can be imported to most of the chemistry-related software, providing three-dimensional visualization and further analysis.
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Chemical structure of Trityl-PEG8-azide
The molecular structure image of Trityl-PEG8-azide is available in chemical structure page of Trityl-PEG8-azide, which provides the molecular geometry information, i.e., the spatial arrangement of atoms in Trityl-PEG8-azide and the chemical bonds that hold the atoms together.
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Chemical formula of Trityl-PEG8-azide
The molecular formula of Trityl-PEG8-azide is given in chemical formula page of Trityl-PEG8-azide, 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 Trityl-PEG8-azide
In addition to the molecular weight information, the structural information of Trityl-PEG8-azide in a textual expression is available via InChi. The full standard InChI of Trityl-PEG8-azide is given below:
InChI=1S/C35H47N3O8/c36-38-37-16-17-39-18-19-40-20-21-41-22-23-42-24-25-43-26-27-44-28-29-45-30-31-46-35(32-10-4-1-5-11-32,33-12-6-2-7-13-33)34-14-8-3-9-15-34/h1-15H,16-31H2
It can provide a way to encode the molecular information of Trityl-PEG8-azide 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 Trityl-PEG8-azide is:
InChIKey=GMEFSMLZCBKWDL-UHFFFAOYSA-N
It may allow easier web searches for Trityl-PEG8-azide. The InChIKey, however, needs to be linked to the full InChI as well in order to get back to the original structure of the Trityl-PEG8-azide as the full standard InChI cannot be reconstructed from the InChIKey.
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Other names (synonyms) or registry numbers of Trityl-PEG8-azide
There may be different names of the Trityl-PEG8-azide compound depending on the various situations of industrial applications, which are given below including the registry numbers if available:
- Trityl-PEG8-azide
Trityl-PEG8-azide Identification Summary Frequently Asked Questions (FAQs)
| What’s the formula of Trityl-PEG8-azide? |
|---|
| C35H47N3O8 |
| How many atoms and what are the elements in the Trityl-PEG8-azide molecule? |
| 93 atom(s) - 47 Hydrogen atom(s), 35 Carbon atom(s), 3 Nitrogen atom(s), and 8 Oxygen atom(s) |
| How many chemical bonds and what types of bonds are in the Trityl-PEG8-azide structure? |
| 95 bond(s) - 48 non-H bond(s), 20 multiple bond(s), 28 rotatable bond(s), 2 double bond(s), 18 aromatic bond(s), 3 six-membered ring(s), 1 positively charged N, and 8 ether(s) (aliphatic) |
| What’s the molar mass of Trityl-PEG8-azide? |
| 637.76298 g/mol |
| What’s the SMILES format of Trityl-PEG8-azide? |
| [N-]=[N+]=NCCOCCOCCOCCOCCOCCOCCOCCOC(c1ccccc1)(c2ccccc2)c3ccccc3 |
| What’s the InChI format of Trityl-PEG8-azide? |
| InChI=1S/C35H47N3O8/c36-38-37-16-17-39-18-19-40-20-21-41-22-23-42-24-25-43-26-27-44-28-29-45-30-31-46-35(32-10-4-1-5-11-32,33-12-6-2-7-13-33)34-14-8-3-9-15-34/h1-15H,16-31H2 |
| What’s the InChIKey string of Trityl-PEG8-azide? |
| GMEFSMLZCBKWDL-UHFFFAOYSA-N |
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Source: Chemical Compounds Deep Data Source (CCDDS; https://www.molinstincts.com) based on 41 patented QSQN and QN
technology
commercialized into Mol-Instincts database and ChemRTP, ChemEssen, Inc (2024).