Molecular Weight of Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide (C8H9NO)
Identification of Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide Chemical Compound
| Chemical Formula | C8H9NO |
|---|---|
| Molecular Weight | 135.16316 g/mol |
| IUPAC Name | 7-(methylnitroso)cyclohepta-1,3,5-triene |
| SMILES String | CN(=O)=c1cccccc1 |
| InChI | InChI=1S/C8H9NO/c1-9(10)8-6-4-2-3-5-7-8/h2-7H,1H3 |
| InChIKey | CXRMQJPLOWKRJD-UHFFFAOYSA-N |
Molecular Weight Description
The Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide molecule consists of 9 Hydrogen atom(s), 8 Carbon atom(s), 1 Nitrogen atom(s), and 1 Oxygen atom(s) - a total of 19 atom(s). The molecular weight of Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide is determined by the sum of the atomic weights of each constituent element multiplied by the number of atoms, which is calculated to be:
$$ 135.16316 · \frac{g}{mol} $$
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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Additional Information for Identifying Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide Molecule
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Structure Data File (SDF/MOL File) of Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide
The structure data file (SDF/MOL File) of Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide is available for download in the SDF page of Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide, which provides the information on atoms, bonds, connectivity and coordinates of Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide. The Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide 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 Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide
The molecular structure image of Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide is available in chemical structure page of Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide, which provides the molecular geometry information, i.e., the spatial arrangement of atoms in Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide and the chemical bonds that hold the atoms together.
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Chemical formula of Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide
The molecular formula of Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide is given in chemical formula page of Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide, 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 Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide
In addition to the molecular weight information, the structural information of Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide in a textual expression is available via InChi. The full standard InChI of Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide is given below:
InChI=1S/C8H9NO/c1-9(10)8-6-4-2-3-5-7-8/h2-7H,1H3
It can provide a way to encode the molecular information of Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide 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 Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide is:
InChIKey=CXRMQJPLOWKRJD-UHFFFAOYSA-N
It may allow easier web searches for Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide. The InChIKey, however, needs to be linked to the full InChI as well in order to get back to the original structure of the Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide as the full standard InChI cannot be reconstructed from the InChIKey.
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Other names (synonyms) or registry numbers of Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide
There may be different names of the Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide compound depending on the various situations of industrial applications, which are given below including the registry numbers if available:
- Methanaminium,N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxy-hydroxide,inner salt
- Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxy-hydroxide
- Methyl(2,4,6-cycloheptatrien-1-ylidene)amine N-oxide
- N-methylcyclohepta-2,4,6-trien-1-imine oxide
- Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide
Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide Identification Summary Frequently Asked Questions (FAQs)
| What’s the formula of Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide? |
|---|
| C8H9NO |
| How many atoms and what are the elements in the Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide molecule? |
| 19 atom(s) - 9 Hydrogen atom(s), 8 Carbon atom(s), 1 Nitrogen atom(s), and 1 Oxygen atom(s) |
| How many chemical bonds and what types of bonds are in the Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide structure? |
| 19 bond(s) - 10 non-H bond(s), 5 multiple bond(s), 5 double bond(s), and 1 seven-membered ring(s) |
| What’s the molar mass of Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide? |
| 135.16316 g/mol |
| What’s the SMILES format of Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide? |
| CN(=O)=c1cccccc1 |
| What’s the InChI format of Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide? |
| InChI=1S/C8H9NO/c1-9(10)8-6-4-2-3-5-7-8/h2-7H,1H3 |
| What’s the InChIKey string of Methanaminium, N-2,4,6-cycloheptatrien-1-ylidene-N-hydroxyhydroxide? |
| CXRMQJPLOWKRJD-UHFFFAOYSA-N |
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commercialized into Mol-Instincts database and ChemRTP, ChemEssen, Inc (2024).