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Structure of 6-(tert-butoxy)picolinic acid (C10H13NO3)

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2D chemical structure image of 6-(tert-butoxy)picolinic acid
Chemical Formula C10H13NO3
Molecular Weight 195.21512 g/mol
IUPAC Name 6-(tert-butoxy)pyridine-2-carboxylic acid
SMILES String CC(C)(C)Oc1cccc(n1)C(O)=O
InChI InChI=1S/C10H13NO3/c1-10(2,3)14-8-6-4-5-7(11-8)9(12)13/h4-6H,1-3H3,(H,12,13)
InChIKey YCQBBBFIVUMNRM-UHFFFAOYSA-N
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Chemical Structure Description

A chemical structure of a molecule includes the arrangement of atoms and the chemical bonds that hold the atoms together. The 6-(tert-butoxy)picolinic acid molecule contains a total of 27 bond(s). There are 14 non-H bond(s), 7 multiple bond(s), 3 rotatable bond(s), 1 double bond(s), 6 aromatic bond(s), 1 six-membered ring(s), 1 carboxylic acid(s) (aromatic), 1 hydroxyl group(s), 1 ether(s) (aromatic), and 1 Pyridine(s). Images of the chemical structure of 6-(tert-butoxy)picolinic acid are given below:

2D chemical structure image of 6-(tert-butoxy)picolinic acid
2-dimensional (2D) chemical structure image of 6-(tert-butoxy)picolinic acid
3D chemical structure image of 6-(tert-butoxy)picolinic acid
3-dimensional (3D) chemical structure image of 6-(tert-butoxy)picolinic acid

The 2D chemical structure image of 6-(tert-butoxy)picolinic acid is also called skeletal formula, which is the standard notation for organic molecules. The carbon atoms in the chemical structure of 6-(tert-butoxy)picolinic acid 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 6-(tert-butoxy)picolinic acid 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 6-(tert-butoxy)picolinic acid. 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 6-(tert-butoxy)picolinic acid is provided here.

The 6-(tert-butoxy)picolinic acid 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 6-(tert-butoxy)picolinic acid 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 6-(tert-butoxy)picolinic acid 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
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  • InChIKey: LFQSCWFLJHTTHZ-UHFFFAOYSA-N

Additional Information for Identifying 6-(tert-butoxy)picolinic acid Molecule

  • Other names (synonyms) or registry numbers of 6-(tert-butoxy)picolinic acid

    The 6-(tert-butoxy)picolinic acid compound may be called differently depending on the various different situations of industrial applications. Below are the list of the other names (synonyms) of 6-(tert-butoxy)picolinic acid including the various registry numbers, if available:

    • 2-PYRIDINECARBOXYLIC ACID 6-(1,1-DIMETHYLETHOXY)-
    • 2-Pyridinecarboxylicacid, 6-(1,1-dimethylethoxy)-
    • 6-tert-Butoxypyridine-2-carboxylic acid
    • 717105-06-1
    • 6-(tert-butoxy)picolinic acid

6-(tert-butoxy)picolinic acid Identification Summary Frequently Asked Questions (FAQs)

What’s the chemical formula of 6-(tert-butoxy)picolinic acid?
C10H13NO3
How many atoms and what are the elements included the 6-(tert-butoxy)picolinic acid molecule?
27 atom(s) - 13 Hydrogen atom(s), 10 Carbon atom(s), 1 Nitrogen atom(s), and 3 Oxygen atom(s)
How many chemical bonds and what kind of bonds are included the 6-(tert-butoxy)picolinic acid structure?
27 bond(s) - 14 non-H bond(s), 7 multiple bond(s), 3 rotatable bond(s), 1 double bond(s), 6 aromatic bond(s), 1 six-membered ring(s), 1 carboxylic acid(s) (aromatic), 1 hydroxyl group(s), 1 ether(s) (aromatic), and 1 Pyridine(s)
What’s the 6-(tert-butoxy)picolinic acid’s molecular weight?
195.21512 g/mol
What’s the SMILES code of 6-(tert-butoxy)picolinic acid?
CC(C)(C)Oc1cccc(n1)C(O)=O
What’s the InChI string of 6-(tert-butoxy)picolinic acid?
InChI=1S/C10H13NO3/c1-10(2,3)14-8-6-4-5-7(11-8)9(12)13/h4-6H,1-3H3,(H,12,13)
What’s the InChIKey code of 6-(tert-butoxy)picolinic acid?
YCQBBBFIVUMNRM-UHFFFAOYSA-N