Formula of NITROSYL CHLORIDE (ClNO)
Identification of NITROSYL CHLORIDE Chemical Compound
Chemical Formula | ClNO |
Molecular Weight | 65.4588 g/mol |
IUPAC Name | nitrooyl chloride |
SMILES String | ClN=O |
InChI | InChI=1S/ClNO/c1-2-3 |
InChIKey | VPCDQGACGWYTMC-UHFFFAOYSA-N |
Chemical Formula Description
The NITROSYL CHLORIDE molecule contains a total of 3 atom(s). There are 1 Nitrogen atom(s), 1 Oxygen atom(s), and 1 Chlorine atom(s). A chemical formula of NITROSYL CHLORIDE can therefore be written as:
ClNO
The chemical formula of NITROSYL CHLORIDE shown above is based on the molecular formula indicating the numbers of each type of atom in a molecule without structural information, which is different from the empirical formula which provides the numerical proportions of atoms of each type.
The above chemical formula is the basis of stoichiometry in chemical equations, i.e., the calculation of relative quantities of reactants and products in chemical reactions. The law of conservation of mass dictates that the quantity of each element given in the chemical formula does not change in a chemical reaction. Thus, each side of the chemical equation must represent the same quantity of any particular element based on the chemical formula.
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- CAS #: 64-17-5
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- Smiles: CCO
- InChI: InChI=1S/C2H6O/c1-2-3/h3H,2H2,1H3
- InChIKey: LFQSCWFLJHTTHZ-UHFFFAOYSA-N
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Additional Information for Identifying NITROSYL CHLORIDE Molecule
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Structure Data File (SDF/MOL File) of NITROSYL CHLORIDE The structure data file (SDF/MOL File) of NITROSYL CHLORIDE is available for download in the SDF page of NITROSYL CHLORIDE providing the information about the atoms, bonds, connectivity and coordinates of NITROSYL CHLORIDE, which is not completely available in the chemical formula representation. The NITROSYL CHLORIDE structure data file can be imported to most of the cheminformatics software for further analysis and visualization.
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Chemical structure of NITROSYL CHLORIDE The chemical structure image of NITROSYL CHLORIDE is available in chemical structure page of NITROSYL CHLORIDE, which specifies the molecular geometry, i.e., the spatial arrangement of atoms in the chemical formula of NITROSYL CHLORIDE and the chemical bonds that hold the atoms together.
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Molecular weight of NITROSYL CHLORIDE The molecular weight of NITROSYL CHLORIDE is available in molecular weight page of NITROSYL CHLORIDE, which is calculated as the sum of the atomic weights of each constituent element multiplied by the number of atoms of that element specified in the chemical formula of NITROSYL CHLORIDE.
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InChI (IUPAC International Chemical Identifier) information of NITROSYL CHLORIDE The molecular chemical formulas lack structural information. An alternative textual expression including the structural information is InChI. The full standard InChI of NITROSYL CHLORIDE is:
InChI=1S/ClNO/c1-2-3
It can provide a standard way to encode the molecular information of NITROSYL CHLORIDE 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 NITROSYL CHLORIDE is:
InChIKey=VPCDQGACGWYTMC-UHFFFAOYSA-N
The InChIKey may allow easier web searches for NITROSYL CHLORIDE, but it needs to be linked to the full InChI to get back to the original structure of the NITROSYL CHLORIDE since the full standard InChI cannot be reconstructed from the InChIKey.
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Other names (synonyms) or registry numbers of NITROSYL CHLORIDE The NITROSYL CHLORIDE compound may have different names depending on the various different situations of industrial applications. The list of the other names (synonyms) of NITROSYL CHLORIDE including the registry numbers is given below, if available:
- 74734-38-6
- Nitrosyl chloride [UN1069] [Poison gas]
- UN 1069
- MFCD00040539
- Nitrogen oxide chloride (NOCl)
- NHE5I1E5H6
- Nitrosyl chloride((NO)Cl)
- Nitrogen chloride oxide
- ONCl
- NOCl
- Nitroso chloride
- Tildens Reagent
- Nitrosylchloride
- Nitrogen oxychloride (NOCl)
- Nitrogen chloride oxide (nocl)
- 2696-92-6
- Nitrosyl chloride ((NO)Cl)
- Nitrosonium chloride
- Nitrogen oxychloride
- NITROSYL CHLORIDE
NITROSYL CHLORIDE Identification Summary Frequently Asked Questions (FAQs)
What’s the chemical formula of NITROSYL CHLORIDE? |
ClNO |
How many atoms and what are they in the NITROSYL CHLORIDE structure? |
3 atom(s) – 1 Nitrogen atom(s), 1 Oxygen atom(s), and 1 Chlorine atom(s) |
How many chemical bonds and what are they in the NITROSYL CHLORIDE structure? |
2 bond(s) – 2 non-H bond(s), 1 multiple bond(s), and 1 double bond(s) |
What’s the molecular weight of NITROSYL CHLORIDE? |
65.4588 g/mol |
What’s the SMILES string of NITROSYL CHLORIDE? |
ClN=O |
What’s the InChI of NITROSYL CHLORIDE? |
InChI=1S/ClNO/c1-2-3 |
What’s the InChIKey of NITROSYL CHLORIDE? |
VPCDQGACGWYTMC-UHFFFAOYSA-N |
1396
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Source: Chemical Compounds Deep Data Source (CCDDS; https://www.molinstincts.com) based on 41 patented SQN and QN technology
commercialized into Mol-Instincts database and ChemRTP, ChemEssen, Inc (2022).