Structure & Deep Data of ISODECYL METHACRYLATE (C14H26O2)
Identification of ISODECYL METHACRYLATE Chemical Compound
Chemical Formula | C14H26O2 |
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Molecular Weight | 226.35504 g/mol |
IUPAC Name | 8-methylnonyl 2-methylprop-2-enoate |
SMILES String | CC(C)CCCCCCCOC(=O)C(C)=C |
InChI | InChI=1S/C14H26O2/c1-12(2)10-8-6-5-7-9-11-16-14(15)13(3)4/h12H,3,5-11H2,1-2,4H3 |
InChIKey | COCLLEMEIJQBAG-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 ISODECYL METHACRYLATE molecule contains a total of 41 bond(s). There are 15 non-H bond(s), 2 multiple bond(s), 10 rotatable bond(s), 2 double bond(s), and 1 ester(s) (aliphatic). Images of the chemical structure of ISODECYL METHACRYLATE are given below:
The 2D chemical structure image of ISODECYL METHACRYLATE is also called skeletal formula, which is the standard notation for organic molecules. The carbon atoms in the chemical structure of ISODECYL METHACRYLATE 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 ISODECYL METHACRYLATE 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 ISODECYL METHACRYLATE. 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 ISODECYL METHACRYLATE is provided here.
The ISODECYL METHACRYLATE 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 ISODECYL METHACRYLATE 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 ISODECYL METHACRYLATE 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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Additional Information for Identifying ISODECYL METHACRYLATE Molecule
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SMILES (Simplified Molecular-Input Line-Entry System) string of ISODECYL METHACRYLATE
The SMILES string of ISODECYL METHACRYLATE is CC(C)CCCCCCCOC(=O)C(C)=C, which can be can be imported by most molecule editors for conversion back into two-dimensional drawings or three-dimensional models of the ISODECYL METHACRYLATE.
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Structure Data File (SDF/MOL File) of ISODECYL METHACRYLATE
The structure data file (SDF/MOL File) of ISODECYL METHACRYLATE is available for download in the SDF page of ISODECYL METHACRYLATE, which provides the information about the atoms, bonds, connectivity and coordinates of ISODECYL METHACRYLATE. The ISODECYL METHACRYLATE structure data file can be imported to most of the cheminformatics software systems and applications.
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Chemical formula of ISODECYL METHACRYLATE
The molecular formula of ISODECYL METHACRYLATE is available in chemical formula page of ISODECYL METHACRYLATE, 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 ISODECYL METHACRYLATE
The molecular weight of ISODECYL METHACRYLATE is available in molecular weight page of ISODECYL METHACRYLATE, 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 ISODECYL METHACRYLATE
The ISODECYL METHACRYLATE compound may be called differently depending on the various different situations of industrial applications. Below are the list of the other names (synonyms) of ISODECYL METHACRYLATE including the various registry numbers, if available:
- 884998-06-5
- 78747-50-9
- 78747-49-6
- 62649-73-4
- 32242-10-7
- 107314-10-3
- I14-18730
- 2-Propenoic acid,2-methyl-, isodecyl ester
- CAS-29964-84-9
- 37200-12-7
- MFCD00053728
- 8-Methylnonyl 2-methylacrylate #
- 2-Propenoic acid, 2-methyl-, isodecyl ester, homopolymer
- Isodecyl methacrylate, 95%
- iso-decyl methacrylate
- IDMA
- 2-Methyl-2-propenoic acid, isodecyl ester
- 8-Methylnonyl methacrylate
- 2-Propenoic acid, 2-methyl-, isodecyl ester
- Isodecyl 2-methylpropenoate
- Methacrylic acid, isodecyl ester
- Isodecyl 2-methyl-2-propenoate
- Ageflex FM-10
- 29964-84-9
- ISODECYL METHACRYLATE
ISODECYL METHACRYLATE Identification Summary Frequently Asked Questions (FAQs)
What’s the chemical formula of ISODECYL METHACRYLATE? |
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C14H26O2 |
How many atoms and what are the elements included the ISODECYL METHACRYLATE molecule? |
42 atom(s) - 26 Hydrogen atom(s), 14 Carbon atom(s), and 2 Oxygen atom(s) |
How many chemical bonds and what kind of bonds are included the ISODECYL METHACRYLATE structure? |
41 bond(s) - 15 non-H bond(s), 2 multiple bond(s), 10 rotatable bond(s), 2 double bond(s), and 1 ester(s) (aliphatic) |
What’s the ISODECYL METHACRYLATE’s molecular weight? |
226.35504 g/mol |
What’s the SMILES code of ISODECYL METHACRYLATE? |
CC(C)CCCCCCCOC(=O)C(C)=C |
What’s the InChI string of ISODECYL METHACRYLATE? |
InChI=1S/C14H26O2/c1-12(2)10-8-6-5-7-9-11-16-14(15)13(3)4/h12H,3,5-11H2,1-2,4H3 |
What’s the InChIKey code of ISODECYL METHACRYLATE? |
COCLLEMEIJQBAG-UHFFFAOYSA-N |
242
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).