Molecular Weight of Vancide PA (C8H16O4S2)
Identification of Vancide PA Chemical Compound
| Chemical Formula | C8H16O4S2 |
|---|---|
| Molecular Weight | 240.34024 g/mol |
| IUPAC Name | 1-{[(E)-2-(propane-1-sulfonyl)ethene]sulfonyl}propane |
| SMILES String | CCCS(=O)(=O)C=CS(=O)(=O)CCC |
| InChI | InChI=1S/C8H16O4S2/c1-3-5-13(9,10)7-8-14(11,12)6-4-2/h7-8H,3-6H2,1-2H3/b8-7+ |
| InChIKey | YTPMCWYIRHLEGM-BQYQJAHWSA-N |
Molecular Weight Description
The Vancide PA molecule consists of 16 Hydrogen atom(s), 8 Carbon atom(s), 4 Oxygen atom(s), and 2 Sulfur atom(s) - a total of 30 atom(s). The molecular weight of Vancide PA is determined by the sum of the atomic weights of each constituent element multiplied by the number of atoms, which is calculated to be:
$$ 240.34024 · \frac{g}{mol} $$
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 Vancide PA Molecule
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Structure Data File (SDF/MOL File) of Vancide PA
The structure data file (SDF/MOL File) of Vancide PA is available for download in the SDF page of Vancide PA, which provides the information on atoms, bonds, connectivity and coordinates of Vancide PA. The Vancide PA 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 Vancide PA
The molecular structure image of Vancide PA is available in chemical structure page of Vancide PA, which provides the molecular geometry information, i.e., the spatial arrangement of atoms in Vancide PA and the chemical bonds that hold the atoms together.
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Chemical formula of Vancide PA
The molecular formula of Vancide PA is given in chemical formula page of Vancide PA, 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 Vancide PA
In addition to the molecular weight information, the structural information of Vancide PA in a textual expression is available via InChi. The full standard InChI of Vancide PA is given below:
InChI=1S/C8H16O4S2/c1-3-5-13(9,10)7-8-14(11,12)6-4-2/h7-8H,3-6H2,1-2H3/b8-7+
It can provide a way to encode the molecular information of Vancide PA 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 Vancide PA is:
InChIKey=YTPMCWYIRHLEGM-BQYQJAHWSA-N
It may allow easier web searches for Vancide PA. The InChIKey, however, needs to be linked to the full InChI as well in order to get back to the original structure of the Vancide PA as the full standard InChI cannot be reconstructed from the InChIKey.
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Other names (synonyms) or registry numbers of Vancide PA
There may be different names of the Vancide PA compound depending on the various situations of industrial applications, which are given below including the registry numbers if available:
- Propane, {1,1'-[1,2-ethenediylbis(sulfonyl)]bis-,} (E)-
- Trans-1, 2-Bis(propylsulfonyl)ethene
- Trans-1, 2-Bis(propylsulfonyl)ethylene
- Vancide PA dispersion
- Propane, 1,1'-(1,2-ethenediylbis(sulfonyl))bis-, (E)- (9CI)
- Preseed
- EPA Pesticide Chemical Code 011701
- Chemagro B-1843
- Caswell No. 099
- B-1843
- (E)-1,2-Bis(propylsulfonyl)ethylene
- (E)-1,1'-(Vinylenebis(sulphonyl))bispropane
- (E)-1,1'-(1,2-Ethenediylbis(sulfonyl)bis(propane))
- 1,2-Bis(propylsulfonyl)ethylene
- 1-(2-propylsulfonylvinylsulfonyl)propane
- 1-[(E)-2-propylsulfonylvinyl]sulfonylpropane
- 1-(2-propylsulfonylethenylsulfonyl)propane
Vancide PA Identification Summary Frequently Asked Questions (FAQs)
| What’s the formula of Vancide PA? |
|---|
| C8H16O4S2 |
| How many atoms and what are the elements in the Vancide PA molecule? |
| 30 atom(s) - 16 Hydrogen atom(s), 8 Carbon atom(s), 4 Oxygen atom(s), and 2 Sulfur atom(s) |
| How many chemical bonds and what types of bonds are in the Vancide PA structure? |
| 29 bond(s) - 13 non-H bond(s), 5 multiple bond(s), 6 rotatable bond(s), 5 double bond(s), and 2 sulfone(s) |
| What’s the molar mass of Vancide PA? |
| 240.34024 g/mol |
| What’s the SMILES format of Vancide PA? |
| CCCS(=O)(=O)C=CS(=O)(=O)CCC |
| What’s the InChI format of Vancide PA? |
| InChI=1S/C8H16O4S2/c1-3-5-13(9,10)7-8-14(11,12)6-4-2/h7-8H,3-6H2,1-2H3/b8-7+ |
| What’s the InChIKey string of Vancide PA? |
| YTPMCWYIRHLEGM-BQYQJAHWSA-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).