Structure & Deep Data of Bisphenol A bis(2-hydroxyethyl ether) dimethacrylate (C27H32O6)
Identification of Bisphenol A bis(2-hydroxyethyl ether) dimethacrylate Chemical Compound
Chemical Formula | C27H32O6 |
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Molecular Weight | 452.53938 g/mol |
IUPAC Name | 2-{4-[2-(4-{2-[(2-methylprop-2-enoyl)oxy]ethoxy}phenyl)propan-2-yl]phenoxy}ethyl 2-methylprop-2-enoate |
SMILES String | CC(=C)C(=O)OCCOc1ccc(cc1)C(C)(C)c2ccc(OCCOC(=O)C(C)=C)cc2 |
InChI | InChI=1S/C27H32O6/c1-19(2)25(28)32-17-15-30-23-11-7-21(8-12-23)27(5,6)22-9-13-24(14-10-22)31-16-18-33-26(29)20(3)4/h7-14H,1,3,15-18H2,2,4-6H3 |
InChIKey | VIYWVRIBDZTTMH-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 Bisphenol A bis(2-hydroxyethyl ether) dimethacrylate molecule contains a total of 66 bond(s). There are 34 non-H bond(s), 16 multiple bond(s), 14 rotatable bond(s), 4 double bond(s), 12 aromatic bond(s), 2 six-membered ring(s), 2 ester(s) (aliphatic), and 2 ether(s) (aromatic). Images of the chemical structure of Bisphenol A bis(2-hydroxyethyl ether) dimethacrylate are given below:
The 2D chemical structure image of Bisphenol A bis(2-hydroxyethyl ether) dimethacrylate is also called skeletal formula, which is the standard notation for organic molecules. The carbon atoms in the chemical structure of Bisphenol A bis(2-hydroxyethyl ether) dimethacrylate 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 Bisphenol A bis(2-hydroxyethyl ether) dimethacrylate 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 Bisphenol A bis(2-hydroxyethyl ether) dimethacrylate. Download structure data file (SDF/MOL) file of this compound.
Interactive 3D Visualization
For a better understanding of the chemical structure, an interactive 3D visualization of Bisphenol A bis(2-hydroxyethyl ether) dimethacrylate is provided here.
The Bisphenol A bis(2-hydroxyethyl ether) dimethacrylate 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 Bisphenol A bis(2-hydroxyethyl ether) dimethacrylate 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 Bisphenol A bis(2-hydroxyethyl ether) dimethacrylate 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 Bisphenol A bis(2-hydroxyethyl ether) dimethacrylate Molecule
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SMILES (Simplified Molecular-Input Line-Entry System) string of Bisphenol A bis(2-hydroxyethyl ether) dimethacrylate
The SMILES string of Bisphenol A bis(2-hydroxyethyl ether) dimethacrylate is CC(=C)C(=O)OCCOc1ccc(cc1)C(C)(C)c2ccc(OCCOC(=O)C(C)=C)cc2, which can be can be imported by most molecule editors for conversion back into two-dimensional drawings or three-dimensional models of the Bisphenol A bis(2-hydroxyethyl ether) dimethacrylate.
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Structure Data File (SDF/MOL File) of Bisphenol A bis(2-hydroxyethyl ether) dimethacrylate
The structure data file (SDF/MOL File) of Bisphenol A bis(2-hydroxyethyl ether) dimethacrylate is available for download in the SDF page of Bisphenol A bis(2-hydroxyethyl ether) dimethacrylate, which provides the information about the atoms, bonds, connectivity and coordinates of Bisphenol A bis(2-hydroxyethyl ether) dimethacrylate. The Bisphenol A bis(2-hydroxyethyl ether) dimethacrylate structure data file can be imported to most of the cheminformatics software systems and applications.
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Chemical formula of Bisphenol A bis(2-hydroxyethyl ether) dimethacrylate
The molecular formula of Bisphenol A bis(2-hydroxyethyl ether) dimethacrylate is available in chemical formula page of Bisphenol A bis(2-hydroxyethyl ether) dimethacrylate, 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 Bisphenol A bis(2-hydroxyethyl ether) dimethacrylate
The molecular weight of Bisphenol A bis(2-hydroxyethyl ether) dimethacrylate is available in molecular weight page of Bisphenol A bis(2-hydroxyethyl ether) dimethacrylate, 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 Bisphenol A bis(2-hydroxyethyl ether) dimethacrylate
The Bisphenol A bis(2-hydroxyethyl ether) dimethacrylate compound may be called differently depending on the various different situations of industrial applications. Below are the list of the other names (synonyms) of Bisphenol A bis(2-hydroxyethyl ether) dimethacrylate including the various registry numbers, if available:
- Poly(oxy-1,2-ethanediyl), alpha,alpha'-((1-methylethylidene)di-4,1-phenylene)bis(omega-((2-methyl-1-oxo-2-propenyl)oxy)-
- Poly(oxy-1,2-ethanediyl), alpha,alpha'-((1-methylethylidene)di-4,1-phenylene)bis(omega-((2-methyl-1-oxo-2-propen-1-yl)oxy)-
- 669775-51-3
- 58517-98-9
- 334825-33-1
- 310883-12-6
- 291773-85-8
- 209273-31-4
- 2-[4-[2-[4-[2-(2-methylprop-2-enoyloxy)ethoxy]phenyl]propan-2-yl]phenoxy]ethyl 2-methylprop-2-enoate
- 180864-38-4
- 178557-93-2
- 167269-51-4
- 162515-87-9
- 146332-61-8
- 144364-48-7
- 144233-27-2
- 141354-82-7
- 141313-09-9
- 139439-68-2
- 138720-61-3
- 138445-97-3
- 132615-47-5
- 132114-23-9
- 131560-72-0
- 131405-46-4
- 130231-12-8
- 120678-47-9
- 119591-83-2
- 118612-28-5
- 115324-81-7
- 114463-96-6
- 114463-89-7
- 111641-63-5
- 111569-54-1
- 111143-48-7
- 109464-65-5
- 109358-88-5
- BISPHENOL A BIS(2-HYDROXYETHYL) ETHER DIMETHY LACRYLATE, STABILIZED
- Bisphenol A, ethoxylated, dimethacrylate
- Ethoxylated bis-phenol A dimethacrylate
- 2-Propenoic acid, 2-methyl-, 1,1'-[(1-methylethylidene)bis(4,1-phenyleneoxy-2,1-ethanediyl)] ester
- 2-Propenoic acid, 2-methyl-, 1,1'-((1-methylethylidene)bis(4,1-phenyleneoxy-2,1-ethanediyl)) ester
- BisMEPP
- 2-Propenoic acid, 2-methyl-, (1-methylethylidene)bis(4,1-phenyleneoxy-2,1-ethanediyl) ester
- 2,2'-(Isopropylidenebis(p-phenyleneoxy))diethylene ester of methacrylic acid
- (1-Methylethylidene)bis(4,1-phenyleneoxy-2,1-ethanediyl) bismethacrylate
- 2,2-Bis(4-(2-(methacryloxy)ethoxy)phenyl) propane
- 2,2-Bis-(4-(2-methacryloxyethoxy)phenyl)propane
- Bisphenol A bis(2-hydroxyethyl ether) dimethacrylate
- 24448-20-2
- 914383-62-3
- 85342-56-9
- 83404-38-0
Bisphenol A bis(2-hydroxyethyl ether) dimethacrylate Identification Summary Frequently Asked Questions (FAQs)
What’s the chemical formula of Bisphenol A bis(2-hydroxyethyl ether) dimethacrylate? |
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C27H32O6 |
How many atoms and what are the elements included the Bisphenol A bis(2-hydroxyethyl ether) dimethacrylate molecule? |
65 atom(s) - 32 Hydrogen atom(s), 27 Carbon atom(s), and 6 Oxygen atom(s) |
How many chemical bonds and what kind of bonds are included the Bisphenol A bis(2-hydroxyethyl ether) dimethacrylate structure? |
66 bond(s) - 34 non-H bond(s), 16 multiple bond(s), 14 rotatable bond(s), 4 double bond(s), 12 aromatic bond(s), 2 six-membered ring(s), 2 ester(s) (aliphatic), and 2 ether(s) (aromatic) |
What’s the Bisphenol A bis(2-hydroxyethyl ether) dimethacrylate’s molecular weight? |
452.53938 g/mol |
What’s the SMILES code of Bisphenol A bis(2-hydroxyethyl ether) dimethacrylate? |
CC(=C)C(=O)OCCOc1ccc(cc1)C(C)(C)c2ccc(OCCOC(=O)C(C)=C)cc2 |
What’s the InChI string of Bisphenol A bis(2-hydroxyethyl ether) dimethacrylate? |
InChI=1S/C27H32O6/c1-19(2)25(28)32-17-15-30-23-11-7-21(8-12-23)27(5,6)22-9-13-24(14-10-22)31-16-18-33-26(29)20(3)4/h7-14H,1,3,15-18H2,2,4-6H3 |
What’s the InChIKey code of Bisphenol A bis(2-hydroxyethyl ether) dimethacrylate? |
VIYWVRIBDZTTMH-UHFFFAOYSA-N |
185
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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).