Molecular Weight of Stauffer R-10669 (C11H12N2O7)
Identification of Stauffer R-10669 Chemical Compound
| Chemical Formula | C11H12N2O7 |
|---|---|
| Molecular Weight | 284.22218 g/mol |
| IUPAC Name | butyl (2,4-dinitrophenyl) carbonate |
| SMILES String | CCCCOC(=O)Oc1ccc(cc1[N+]([O-])=O)[N+]([O-])=O |
| InChI | InChI=1S/C11H12N2O7/c1-2-3-6-19-11(14)20-10-5-4-8(12(15)16)7-9(10)13(17)18/h4-5,7H,2-3,6H2,1H3 |
| InChIKey | UKVCWXQPMRARHZ-UHFFFAOYSA-N |
Molecular Weight Description
The Stauffer R-10669 molecule consists of 12 Hydrogen atom(s), 11 Carbon atom(s), 2 Nitrogen atom(s), and 7 Oxygen atom(s) - a total of 32 atom(s). The molecular weight of Stauffer R-10669 is determined by the sum of the atomic weights of each constituent element multiplied by the number of atoms, which is calculated to be:
$$ 284.22218 · \frac{g}{mol} $$
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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- InChIKey: LFQSCWFLJHTTHZ-UHFFFAOYSA-N
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Additional Information for Identifying Stauffer R-10669 Molecule
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Structure Data File (SDF/MOL File) of Stauffer R-10669
The structure data file (SDF/MOL File) of Stauffer R-10669 is available for download in the SDF page of Stauffer R-10669, which provides the information on atoms, bonds, connectivity and coordinates of Stauffer R-10669. The Stauffer R-10669 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 Stauffer R-10669
The molecular structure image of Stauffer R-10669 is available in chemical structure page of Stauffer R-10669, which provides the molecular geometry information, i.e., the spatial arrangement of atoms in Stauffer R-10669 and the chemical bonds that hold the atoms together.
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Chemical formula of Stauffer R-10669
The molecular formula of Stauffer R-10669 is given in chemical formula page of Stauffer R-10669, 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 Stauffer R-10669
In addition to the molecular weight information, the structural information of Stauffer R-10669 in a textual expression is available via InChi. The full standard InChI of Stauffer R-10669 is given below:
InChI=1S/C11H12N2O7/c1-2-3-6-19-11(14)20-10-5-4-8(12(15)16)7-9(10)13(17)18/h4-5,7H,2-3,6H2,1H3
It can provide a way to encode the molecular information of Stauffer R-10669 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 Stauffer R-10669 is:
InChIKey=UKVCWXQPMRARHZ-UHFFFAOYSA-N
It may allow easier web searches for Stauffer R-10669. The InChIKey, however, needs to be linked to the full InChI as well in order to get back to the original structure of the Stauffer R-10669 as the full standard InChI cannot be reconstructed from the InChIKey.
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Other names (synonyms) or registry numbers of Stauffer R-10669
There may be different names of the Stauffer R-10669 compound depending on the various situations of industrial applications, which are given below including the registry numbers if available:
- Butyl-2,4-dinitrofenylester kyseliny uhlicite
- 15741-91-0
- Butyl-2,4-dinitrofenylester kyseliny uhlicite [Czech]
- CARBONIC ACID, BUTYL 2,4-DINITROPHENYL ESTER
- ENT 27,364
- R-10669
- Butyl 2,4-dinitrophenyl carbonate
- Stauffer R-10669
Stauffer R-10669 Identification Summary Frequently Asked Questions (FAQs)
| What’s the formula of Stauffer R-10669? |
|---|
| C11H12N2O7 |
| How many atoms and what are the elements in the Stauffer R-10669 molecule? |
| 32 atom(s) - 12 Hydrogen atom(s), 11 Carbon atom(s), 2 Nitrogen atom(s), and 7 Oxygen atom(s) |
| How many chemical bonds and what types of bonds are in the Stauffer R-10669 structure? |
| 32 bond(s) - 20 non-H bond(s), 11 multiple bond(s), 8 rotatable bond(s), 5 double bond(s), 6 aromatic bond(s), 1 six-membered ring(s), 1 carbonate (-thio) derivative(s), and 2 nitro group(s) (aromatic) |
| What’s the molar mass of Stauffer R-10669? |
| 284.22218 g/mol |
| What’s the SMILES format of Stauffer R-10669? |
| CCCCOC(=O)Oc1ccc(cc1[N+]([O-])=O)[N+]([O-])=O |
| What’s the InChI format of Stauffer R-10669? |
| InChI=1S/C11H12N2O7/c1-2-3-6-19-11(14)20-10-5-4-8(12(15)16)7-9(10)13(17)18/h4-5,7H,2-3,6H2,1H3 |
| What’s the InChIKey string of Stauffer R-10669? |
| UKVCWXQPMRARHZ-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).