Structure & Deep Data of Ethiofencarb (C11H15NO2S)
Identification of Ethiofencarb Chemical Compound
| Chemical Formula | C11H15NO2S |
|---|---|
| Molecular Weight | 225.3073 g/mol |
| IUPAC Name | 2-[(ethylsulfanyl)methyl]phenyl N-methylcarbamate |
| SMILES String | CCSCc1ccccc1OC(=O)NC |
| InChI | InChI=1S/C11H15NO2S/c1-3-15-8-9-6-4-5-7-10(9)14-11(13)12-2/h4-7H,3,8H2,1-2H3,(H,12,13) |
| InChIKey | HEZNVIYQEUHLNI-UHFFFAOYSA-N |
Chemical Structure Description
A chemical structure of a molecule includes the arrangement of atoms and the chemical bonds that hold the atoms together. The Ethiofencarb molecule contains a total of 30 bond(s). There are 15 non-H bond(s), 7 multiple bond(s), 5 rotatable bond(s), 1 double bond(s), 6 aromatic bond(s), 1 six-membered ring(s), 1 (thio-) carbamate(s) (aromatic), and 1 sulfide(s). Images of the chemical structure of Ethiofencarb are given below:
The 2D chemical structure image of Ethiofencarb is also called skeletal formula, which is the standard notation for organic molecules. The carbon atoms in the chemical structure of Ethiofencarb are implied to be located at the corner(s) and hydrogen atoms attached to carbon atoms are not indicated – each carbon atom is considered to be associated with enough hydrogen atoms to provide the carbon atom with four bonds.
The 3D chemical structure image of Ethiofencarb is based on the ball-and-stick model which displays both the three-dimensional position of the atoms and the bonds between them. The radius of the spheres is therefore smaller than the rod lengths in order to provide a clearer view of the atoms and bonds throughout the chemical structure model of Ethiofencarb. Download structure data file (SDF/MOL) file of this compound.
chemical table area
Interactive 3D Visualization
For a better understanding of the chemical structure, an interactive 3D visualization of Ethiofencarb is provided here.
The Ethiofencarb molecule shown in the visualization screen can be rotated interactively by keep clicking and moving the mouse button. Mouse wheel zoom is available as well – the size of the Ethiofencarb molecule can be increased or decreased by scrolling the mouse wheel.
The information of the atoms, bonds, connectivity and coordinates included in the chemical structure of Ethiofencarb can easily be identified by this visualization. By right-clicking the visualization screen, various other options are available including the visualization of van der Waals surface and exporting to an image file.
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- Name: ethanol
- CAS #: 64-17-5
- Formula: C2H5OH
- Smiles: CCO
- InChI: InChI=1S/C2H6O/c1-2-3/h3H,2H2,1H3
- InChIKey: LFQSCWFLJHTTHZ-UHFFFAOYSA-N
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Additional Information for Identifying Ethiofencarb Molecule
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SMILES (Simplified Molecular-Input Line-Entry System) string of Ethiofencarb
The SMILES string of Ethiofencarb is CCSCc1ccccc1OC(=O)NC, which can be can be imported by most molecule editors for conversion back into two-dimensional drawings or three-dimensional models of the Ethiofencarb.
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Structure Data File (SDF/MOL File) of Ethiofencarb
The structure data file (SDF/MOL File) of Ethiofencarb is available for download in the SDF page of Ethiofencarb, which provides the information about the atoms, bonds, connectivity and coordinates of Ethiofencarb. The Ethiofencarb structure data file can be imported to most of the cheminformatics software systems and applications.
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Chemical formula of Ethiofencarb
The molecular formula of Ethiofencarb is available in chemical formula page of Ethiofencarb, which identifies each constituent element by its chemical symbol and indicates the proportionate number of atoms of each element.
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Molecular weight of Ethiofencarb
The molecular weight of Ethiofencarb is available in molecular weight page of Ethiofencarb, which is calculated as the sum of the atomic weights of each constituent element multiplied by the number of atoms of that element in the molecular formula.
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Other names (synonyms) or registry numbers of Ethiofencarb
The Ethiofencarb compound may be called differently depending on the various different situations of industrial applications. Below are the list of the other names (synonyms) of Ethiofencarb including the various registry numbers, if available:
- 56730-58-6
- 56729-20-5
- Carbamic acid, methyl-, alpha-(ethylthio)-o-tolyl ester (8CI)
- Phenol, 2-((ethylthio)methyl)-, methylcarbamate (9CI)
- Carbamic acid, methyl-, alpha-(ethylthio)-o-tolyl ester
- I01-10296
- J-017713
- Ethiofencarb, PESTANAL(R), analytical standard
- CAS-29973-13-5
- 2-ethylthiomethyl-phenyl N-methyl-carbamate
- .alpha.-Ethylthio-o-tolyl methylcarbamate
- MFCD00055463
- BDBM50253090
- Carbamic acid, methyl-, .alpha.-(ethylthio)-o-tolyl ester
- 2-(ethylthiomethyl)phenyl esterd
- HOX 1901d
- C5H11NNa2O6S4
- FY0YB813XV
- methylcarbamate (9CI)
- 2-?(ethylthio)methyld
- 2-(ethylthio)methyld
- Phenod
- methylcarbamated
- Cronetond
- Ethiophencarpd
- Ethiofencarbd
- methyld
- ethiophencarbed
- Ethiophencarbe
- Carbamic acid, methyl-, 2-(ethylthiomethyl)phenyl ester
- Phenol, 2-((ethylthio)methyl)-, methylcarbamate
- [2-(ethylsulfanylmethyl)phenyl] N-methylcarbamate
- 2-(ethylthiomethyl) phenyl methylcarbamate
- alpha-(Ethylthio)-o-tolyl methylcarbamate [ISO:BSI]
- Phenol, 2-[(ethylthio)methyl]-, methylcarbamate
- 2-[(Ethylsulfanyl)methyl]phenyl methylcarbamate
- 2-Ethyl-mercaptomethyl-phenyl-N-methylcarbamate
- 2-[(Ethylthio)methyl]phenyl N-methylcarbamate
- (2-Ethylthiomethyl-phenyl)-N-methylcarbamate
- 2-Ethylthiomethylphenyl N-methylcarbamate
- EPA Pesticide Chemical Code 112101
- alpha-(Ethylthio)-o-tolyl methylcarbamate
- BAY-HOX-1901
- Ethiophencarbe [ISO-French]
- 2-((Ethylthio)methyl)phenyl methylcarbamate
- 2-((Ethylthio)methyl)phenol methylcarbamate
- Ethiofencarb [BSI:ISO]
- CHOX 1901
- Caswell No. 263AA
- alpha-Ethylthio-o-tolyl methylcarbamate
- Hox 1901
- Kronetone
- Bisultap
- Croneton 500
- Arylmate
- 29973-13-5
- CRONETON
- Ethiofencarb
Ethiofencarb Identification Summary Frequently Asked Questions (FAQs)
| What’s the chemical formula of Ethiofencarb? |
|---|
| C11H15NO2S |
| How many atoms and what are the elements included the Ethiofencarb molecule? |
| 30 atom(s) - 15 Hydrogen atom(s), 11 Carbon atom(s), 1 Nitrogen atom(s), 2 Oxygen atom(s), and 1 Sulfur atom(s) |
| How many chemical bonds and what kind of bonds are included the Ethiofencarb structure? |
| 30 bond(s) - 15 non-H bond(s), 7 multiple bond(s), 5 rotatable bond(s), 1 double bond(s), 6 aromatic bond(s), 1 six-membered ring(s), 1 (thio-) carbamate(s) (aromatic), and 1 sulfide(s) |
| What’s the Ethiofencarb’s molecular weight? |
| 225.3073 g/mol |
| What’s the SMILES code of Ethiofencarb? |
| CCSCc1ccccc1OC(=O)NC |
| What’s the InChI string of Ethiofencarb? |
| InChI=1S/C11H15NO2S/c1-3-15-8-9-6-4-5-7-10(9)14-11(13)12-2/h4-7H,3,8H2,1-2H3,(H,12,13) |
| What’s the InChIKey code of Ethiofencarb? |
| HEZNVIYQEUHLNI-UHFFFAOYSA-N |
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The contents of this page can freely be shared if cited as follows:
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).