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Structure of 3-CHLOROPHENYL CYCLOPENTYL KETONE (C12H13ClO)

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2D chemical structure image of 3-CHLOROPHENYL CYCLOPENTYL KETONE
Chemical Formula C12H13ClO
Molecular Weight 208.68372 g/mol
IUPAC Name (3-chlorophenyl)(cyclopentyl)methanone
SMILES String Clc1cccc(c1)C(=O)C2CCCC2
InChI InChI=1S/C12H13ClO/c13-11-7-3-6-10(8-11)12(14)9-4-1-2-5-9/h3,6-9H,1-2,4-5H2
InChIKey XOIRTJDXSCKPCE-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 3-CHLOROPHENYL CYCLOPENTYL KETONE molecule contains a total of 28 bond(s). There are 15 non-H bond(s), 7 multiple bond(s), 2 rotatable bond(s), 1 double bond(s), 6 aromatic bond(s), 1 five-membered ring(s), 1 six-membered ring(s), and 1 ketone(s) (aromatic). Images of the chemical structure of 3-CHLOROPHENYL CYCLOPENTYL KETONE are given below:

2D chemical structure image of 3-CHLOROPHENYL CYCLOPENTYL KETONE
2-dimensional (2D) chemical structure image of 3-CHLOROPHENYL CYCLOPENTYL KETONE
3D chemical structure image of 3-CHLOROPHENYL CYCLOPENTYL KETONE
3-dimensional (3D) chemical structure image of 3-CHLOROPHENYL CYCLOPENTYL KETONE

The 2D chemical structure image of 3-CHLOROPHENYL CYCLOPENTYL KETONE is also called skeletal formula, which is the standard notation for organic molecules. The carbon atoms in the chemical structure of 3-CHLOROPHENYL CYCLOPENTYL KETONE 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 3-CHLOROPHENYL CYCLOPENTYL KETONE 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 3-CHLOROPHENYL CYCLOPENTYL KETONE. 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 3-CHLOROPHENYL CYCLOPENTYL KETONE is provided here.

The 3-CHLOROPHENYL CYCLOPENTYL KETONE 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 3-CHLOROPHENYL CYCLOPENTYL KETONE 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 3-CHLOROPHENYL CYCLOPENTYL KETONE 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

Additional Information for Identifying 3-CHLOROPHENYL CYCLOPENTYL KETONE Molecule

  • Other names (synonyms) or registry numbers of 3-CHLOROPHENYL CYCLOPENTYL KETONE

    The 3-CHLOROPHENYL CYCLOPENTYL KETONE compound may be called differently depending on the various different situations of industrial applications. Below are the list of the other names (synonyms) of 3-CHLOROPHENYL CYCLOPENTYL KETONE including the various registry numbers, if available:

    • MFCD03841307
    • Cyclopentyl(3-chlorophenyl)methanone
    • (3-Chlorophenyl)cyclopentylmethanone
    • m-chlorophenyl cyclopentyl ketone
    • 1855-40-9
    • 3-CHLOROPHENYL CYCLOPENTYL KETONE

3-CHLOROPHENYL CYCLOPENTYL KETONE Identification Summary Frequently Asked Questions (FAQs)

What’s the chemical formula of 3-CHLOROPHENYL CYCLOPENTYL KETONE?
C12H13ClO
How many atoms and what are the elements included the 3-CHLOROPHENYL CYCLOPENTYL KETONE molecule?
27 atom(s) - 13 Hydrogen atom(s), 12 Carbon atom(s), 1 Oxygen atom(s), and 1 Chlorine atom(s)
How many chemical bonds and what kind of bonds are included the 3-CHLOROPHENYL CYCLOPENTYL KETONE structure?
28 bond(s) - 15 non-H bond(s), 7 multiple bond(s), 2 rotatable bond(s), 1 double bond(s), 6 aromatic bond(s), 1 five-membered ring(s), 1 six-membered ring(s), and 1 ketone(s) (aromatic)
What’s the 3-CHLOROPHENYL CYCLOPENTYL KETONE’s molecular weight?
208.68372 g/mol
What’s the SMILES code of 3-CHLOROPHENYL CYCLOPENTYL KETONE?
Clc1cccc(c1)C(=O)C2CCCC2
What’s the InChI string of 3-CHLOROPHENYL CYCLOPENTYL KETONE?
InChI=1S/C12H13ClO/c13-11-7-3-6-10(8-11)12(14)9-4-1-2-5-9/h3,6-9H,1-2,4-5H2
What’s the InChIKey code of 3-CHLOROPHENYL CYCLOPENTYL KETONE?
XOIRTJDXSCKPCE-UHFFFAOYSA-N