Structure & Deep Data of BENZOPHENONE (C13H10O)

Chemical Structure Description

A chemical structure of a molecule includes the arrangement of atoms and the chemical bonds that hold the atoms together. The BENZOPHENONE molecule contains a total of 25 bond(s). There are 15 non-H bond(s), 13 multiple bond(s), 2 rotatable bond(s), 1 double bond(s), 12 aromatic bond(s), 2 six-membered ring(s), and 1 ketone(s) (aromatic). Images of the chemical structure of BENZOPHENONE are given below:

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

---

chemical table area

Search Another Chemical Structure

Enter another compound to search for chemical structure:

Deep Data Application Examples

Our Deep Data encompasses property data, spectral data, quantum chemical data, and molecular descriptor data for a wide range of chemical compounds. It features more than 2,100 high-quality datasets per single chemical compound, totaling over 8 billion datasets for 4.1+ million chemical compounds. Below are some application examples that may interest you:

Additional Information for Identifying BENZOPHENONE Molecule

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

  The SMILES string of BENZOPHENONE is O=C(c1ccccc1)c2ccccc2, which can be can be imported by most molecule editors for conversion back into two-dimensional drawings or three-dimensional models of the BENZOPHENONE.

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

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

• Chemical formula of BENZOPHENONE

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

• Molecular weight of BENZOPHENONE

  The molecular weight of BENZOPHENONE is available in molecular weight page of BENZOPHENONE, 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 BENZOPHENONE

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

  • T7103995
  • EN300-19181
  • BBV-46883622
  • Mettler-Toledo Calibration substance ME 18870, Benzophenone, for the calibration of the thermosystem 900, traceable to primary standards (LGC)
  • 852361-03-6
  • 3-((R)-1-(2,6-dichloro-3-fluorophenyl)ethoxy)-5-(1-(piperidin-4-yl)-1H-pyrazol-4-yl)pyridin-2-amine
  • Benzophenone, United States Pharmacopeia (USP) Reference Standard
  • Benzophenone, pharmaceutical secondary standard; traceable to PhEur
  • Benzophenone, European Pharmacopoeia (EP) Reference Standard
  • METTLER-TOLEDO(R) CALIBRATION SUBSTANCE ME 18870

  • Z1245792986
  • F0001-0309
  • Q-200691
  • Melting point standard 47-49C, analytical standard
  • I14-8023
  • Benzophenone, Vetec(TM) reagent grade, 98%
  • Benzophenone, purified by sublimation, >=99%
  • B0083
  • Benzophenone, SAJ first grade, >=99.0%
  • Benzophenone, ReagentPlus(R), >=99%

  • Benzophenone, purum, >=99.0% (GC)
  • RTR-023462
  • BENZOPHENONE (DIPHENYL-KETONE)
  • Benzophenone, for synthesis, 98.0%
  • Benzophenone, ReagentPlus(R), 99%
  • METHANONE, DIPHENYL- (9CI)
  • Benzophenone, >=99%, FCC, FG
  • LABOTEST-BB LTBB001874
  • HMS2268A24
  • OTAVA-BB 1043895

  • TIMTEC-BB SBB040865
  • FEMA 2134
  • Benzophenone, analytical standard
  • BDBM22726
  • UPCMLD-DP071:001
  • 701M4TTV9O
  • BIDD:ER0022
  • Benzophenone, 99% 250g
  • BIDD:PXR0008
  • BENZOPHENONE (8CI)

  • UPCMLD-DP071
  • Adjutan 6016
  • Ph2CO
  • BENZOPHE
  • Benzophenone Flakes
  • 1dzp
  • Benzophenone FCC
  • Diphenyl-methanon
  • Benzophenon krist
  • meta-benzophenone

  • Kayacure bp
  • Benzophenon
  • CAS-119-61-9
  • MFCD00003076
  • phenylketone
  • EPA Pesticide Chemical Code 000315
  • .alpha.-Oxodiphenylmethane
  • FEMA No. 2134
  • .alpha.-Oxoditane
  • Caswell No. 081G

  • diphenyl-methanone
  • Diphenylketone
  • alpha-Oxodiphenylmethane
  • Ketone, diphenyl
  • alpha-Oxoditane
  • Benzene, benzoyl-
  • Methanone, diphenyl-
  • Phenyl ketone
  • Benzoylbenzene
  • 119-61-9

  • Diphenyl ketone
  • BENZOPHENONE

---

BENZOPHENONE Identification Summary Frequently Asked Questions (FAQs)

What’s the chemical formula of BENZOPHENONE?
C13H10O
How many atoms and what are the elements included the BENZOPHENONE molecule?
24 atom(s) - 10 Hydrogen atom(s), 13 Carbon atom(s), and 1 Oxygen atom(s)
How many chemical bonds and what kind of bonds are included the BENZOPHENONE structure?
25 bond(s) - 15 non-H bond(s), 13 multiple bond(s), 2 rotatable bond(s), 1 double bond(s), 12 aromatic bond(s), 2 six-membered ring(s), and 1 ketone(s) (aromatic)
What’s the BENZOPHENONE’s molecular weight?
182.2179 g/mol
What’s the SMILES code of BENZOPHENONE?
O=C(c1ccccc1)c2ccccc2
What’s the InChI string of BENZOPHENONE?
InChI=1S/C13H10O/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H
What’s the InChIKey code of BENZOPHENONE?
RWCCWEUUXYIKHB-UHFFFAOYSA-N

9530 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).