Home Structure This Compound
loading

Structure of 4'-Chloroacetophenone (C8H7ClO)

Powered by CC-DPS Delivering 2,100+ Information Sets per Compound.

2D chemical structure image of 4'-Chloroacetophenone
Chemical Formula C8H7ClO
Molecular Weight 154.59328 g/mol
IUPAC Name 1-(4-chlorophenyl)ethan-1-one
SMILES String CC(=O)c1ccc(Cl)cc1
InChI InChI=1S/C8H7ClO/c1-6(10)7-2-4-8(9)5-3-7/h2-5H,1H3
InChIKey BUZYGTVTZYSBCU-UHFFFAOYSA-N
Citation CC-DPS (Chemical Compounds Deep Profiling Services; https://www.cc-dps.com) powered by 41 patented QSQN technology based on Quantum Chemistry, Statistical Thermodynamics, Quantitative Structure-Property Relationship (QSPR), and Neural Network.

Content on this page is sourced from CC-DPS (Chemical Compounds Deep Profiling Services), which provides more than 2,100 additional essential information sets for each chemical compound. Discover CC-DPS

Chemical Structure Description

A chemical structure of a molecule includes the arrangement of atoms and the chemical bonds that hold the atoms together. The 4'-Chloroacetophenone molecule contains a total of 17 bond(s). There are 10 non-H bond(s), 7 multiple bond(s), 1 rotatable bond(s), 1 double bond(s), 6 aromatic bond(s), 1 six-membered ring(s), and 1 ketone(s) (aromatic). Images of the chemical structure of 4'-Chloroacetophenone are given below:

2D chemical structure image of 4'-Chloroacetophenone
2-dimensional (2D) chemical structure image of 4'-Chloroacetophenone
3D chemical structure image of 4'-Chloroacetophenone
3-dimensional (3D) chemical structure image of 4'-Chloroacetophenone

The 2D chemical structure image of 4'-Chloroacetophenone is also called skeletal formula, which is the standard notation for organic molecules. The carbon atoms in the chemical structure of 4'-Chloroacetophenone 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 4'-Chloroacetophenone 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 4'-Chloroacetophenone. 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 4'-Chloroacetophenone is provided here.

The 4'-Chloroacetophenone 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 4'-Chloroacetophenone 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 4'-Chloroacetophenone 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.


Search Another Chemical Structure

Enter another compound to search for chemical structure:

Input a chemical compound consisting of C, H, N, O, S, F, Cl, Br, I, Si, P, and/or As atom(s)

Input example for Ethanol:

  • 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 4'-Chloroacetophenone Molecule

  • Other names (synonyms) or registry numbers of 4'-Chloroacetophenone

    The 4'-Chloroacetophenone compound may be called differently depending on the various different situations of industrial applications. Below are the list of the other names (synonyms) of 4'-Chloroacetophenone including the various registry numbers, if available:

    • T7106877
    • BBV-46875822
    • EN300-17998
    • F2147-0328
    • Z57127462
    • Q-200456
    • I01-6210
    • A846097
    • M-6154
    • 4 inverted exclamation mark -chloro-acetophenon
    • RTR-030499
    • LABOTEST-BB LT01147632
    • BDBM50304447
    • ANW-41077
    • ZV4A71K303
    • 4-CHLORO-1-ACETYLBENZENE
    • 1-(4-chlorophenyl)ethanone[qr]
    • 4'-Chloroacetophenone, 97%
    • 1-(4-chlorophenyl)-ethanon
    • acetophenone,4-chloro-[qr]
    • bmse000518
    • 4-chlorophenylmethylketone
    • 4-chloroacetophenone[qr]
    • 4-chloro acetophenone
    • p-chloro-acetophenone
    • p'-chloroacetophenone
    • MFCD00000624
    • Acetophenone, 4'-chloro- (8CI)
    • 1-(4-chloro-phenyl)-ethanone
    • 1-acetyl-4-chlorobenzene
    • chloroacetophenone-4
    • Methyl 4-chlorophenyl ketone
    • 4-Chlorophenyl methyl ketone
    • p-Chlorophenyl methyl ketone
    • Methyl p-chlorophenyl ketone
    • 1-(4-Chlorophenyl)-ethanone
    • USAF DO-1
    • p-Acetylchlorobenzene
    • p-Chloracetophenone
    • 4-Acetylchlorobenzene
    • Acetophenone, 4'-chloro-
    • Ethanone, 1-(4-chlorophenyl)-
    • P-CHLOROACETOPHENONE
    • 4-Chloroacetophenone
    • 99-91-2
    • 1-(4-Chlorophenyl)ethanone
    • 4'-Chloroacetophenone

4'-Chloroacetophenone Identification Summary Frequently Asked Questions (FAQs)

What’s the chemical formula of 4'-Chloroacetophenone?
C8H7ClO
How many atoms and what are the elements included the 4'-Chloroacetophenone molecule?
17 atom(s) - 7 Hydrogen atom(s), 8 Carbon atom(s), 1 Oxygen atom(s), and 1 Chlorine atom(s)
How many chemical bonds and what kind of bonds are included the 4'-Chloroacetophenone structure?
17 bond(s) - 10 non-H bond(s), 7 multiple bond(s), 1 rotatable bond(s), 1 double bond(s), 6 aromatic bond(s), 1 six-membered ring(s), and 1 ketone(s) (aromatic)
What’s the 4'-Chloroacetophenone’s molecular weight?
154.59328 g/mol
What’s the SMILES code of 4'-Chloroacetophenone?
CC(=O)c1ccc(Cl)cc1
What’s the InChI string of 4'-Chloroacetophenone?
InChI=1S/C8H7ClO/c1-6(10)7-2-4-8(9)5-3-7/h2-5H,1H3
What’s the InChIKey code of 4'-Chloroacetophenone?
BUZYGTVTZYSBCU-UHFFFAOYSA-N