Structure & Deep Data of CYCLOHEXANONE (C6H10O)

Chemical Structure Description

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

The 2D chemical structure image of CYCLOHEXANONE is also called skeletal formula, which is the standard notation for organic molecules. The carbon atoms in the chemical structure of CYCLOHEXANONE 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 CYCLOHEXANONE 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 CYCLOHEXANONE. Download structure data file (SDF/MOL) file of this compound.

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Additional Information for Identifying CYCLOHEXANONE Molecule

• SMILES (Simplified Molecular-Input Line-Entry System) string of CYCLOHEXANONE

  The SMILES string of CYCLOHEXANONE is O=C1CCCCC1, which can be can be imported by most molecule editors for conversion back into two-dimensional drawings or three-dimensional models of the CYCLOHEXANONE.

• Structure Data File (SDF/MOL File) of CYCLOHEXANONE

  The structure data file (SDF/MOL File) of CYCLOHEXANONE is available for download in the SDF page of CYCLOHEXANONE, which provides the information about the atoms, bonds, connectivity and coordinates of CYCLOHEXANONE. The CYCLOHEXANONE structure data file can be imported to most of the cheminformatics software systems and applications.

• Chemical formula of CYCLOHEXANONE

  The molecular formula of CYCLOHEXANONE is available in chemical formula page of CYCLOHEXANONE, which identifies each constituent element by its chemical symbol and indicates the proportionate number of atoms of each element.

• Molecular weight of CYCLOHEXANONE

  The molecular weight of CYCLOHEXANONE is available in molecular weight page of CYCLOHEXANONE, 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.

• Other names (synonyms) or registry numbers of CYCLOHEXANONE

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

  • BBV-46883748
  • 11119-77-0
  • cyclohexanon, homopolymer (mittlere molmasse 415-750 g/mol)
  • Z955123528
  • F0001-0185
  • I14-53082
  • I14-20861
  • J-520160
  • I01-1194
  • Cyclohexanone, puriss. p.a., >=99.5% (GC)

  • Cyclohexanone, Vetec(TM) reagent grade, 98%
  • Cyclohexanone, JIS special grade, >=99.0%
  • Cyclohexanone [UN1915] [Flammable liquid]
  • Y1320
  • Cyclohexanone, Selectophore(TM), >=99.5%
  • Cyclohexanone [UN1915] [Flammable liquid]
  • Cyclohexanone, SAJ first grade, >=98.0%
  • Cyclohexanone, puriss., >=99.5% (GC)
  • Cyclohexanone, ReagentPlus(R), 99.8%
  • Cyclohexanone, ACS reagent, >=99.0%

  • UN 1915
  • RTR-002012
  • ANW-15994
  • Cyclohexanone - Reagent Grade ACS
  • HMS3039C04
  • Cyclohexanone, analytical standard
  • Cyclohexanone, AR, >=99.5%
  • HMDB03315
  • Cyclohexanone, p.a., 99.0%
  • Cyclohexanone (Industrial Grade)

  • Cyclohexanone, 99% 100ml
  • 5QOR3YM052
  • Cyclohexanone, LR, >=99%
  • BIDD:ER0292
  • CYCLOHEXYL, 2-OXO-
  • bmse000405
  • CYCLOHEXANONE, ACS
  • Cyclohexanone, 99.8%
  • Cyclohexanone homopolymer
  • BDBM6

  • cyclohexanone,homopolymer
  • resins, cyclohexanone
  • Cyclohexanon(dutch)
  • Hydrol-e
  • 2-cyclohexanone
  • hexanoe
  • CAS-108-94-1
  • 9075-99-4
  • CYH
  • Cyclohexanone-1-13C

  • 9003-41-2
  • MFCD00001625
  • cyclohexan-1-one
  • cyclohexyloxy
  • EPA Pesticide Chemical Code 025902
  • RCRA waste no. U057
  • POLYCYCLOHEXANONE
  • Cykloheksanon [Polish]
  • Cicloesanone [Italian]
  • Caswell No. 270

  • Cyclohexanon [Dutch]
  • Cyclic ketone
  • RCRA waste number U057
  • Hytrolo
  • Cyclohexanone, homopolymer
  • Cykloheksanon
  • Cicloesanone
  • Pimelin ketone
  • oxocyclohexane
  • ketocyclohexane

  • Cyclohexanon
  • Hytrol O
  • Hexanon
  • Anon
  • Anone
  • Nadone
  • Cyclohexyl ketone
  • Sextone
  • Ketohexamethylene
  • Pimelic ketone

  • 108-94-1

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CYCLOHEXANONE Identification Summary Frequently Asked Questions (FAQs)

What’s the chemical formula of CYCLOHEXANONE?
C6H10O
How many atoms and what are the elements included the CYCLOHEXANONE molecule?
17 atom(s) - 10 Hydrogen atom(s), 6 Carbon atom(s), and 1 Oxygen atom(s)
How many chemical bonds and what kind of bonds are included the CYCLOHEXANONE structure?
17 bond(s) - 7 non-H bond(s), 1 multiple bond(s), 1 double bond(s), 1 six-membered ring(s), and 1 ketone(s) (aliphatic)
What’s the CYCLOHEXANONE’s molecular weight?
98.143 g/mol
What’s the SMILES code of CYCLOHEXANONE?
O=C1CCCCC1
What’s the InChI string of CYCLOHEXANONE?
InChI=1S/C6H10O/c7-6-4-2-1-3-5-6/h1-5H2
What’s the InChIKey code of CYCLOHEXANONE?
JHIVVAPYMSGYDF-UHFFFAOYSA-N

12961 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).