Structure & Deep Data of (R)-4-Chlorobenzhydrol (C13H11ClO)

Chemical Structure Description

A chemical structure of a molecule includes the arrangement of atoms and the chemical bonds that hold the atoms together. The (R)-4-Chlorobenzhydrol molecule contains a total of 27 bond(s). There are 16 non-H bond(s), 12 multiple bond(s), 2 rotatable bond(s), 12 aromatic bond(s), 2 six-membered ring(s), 1 hydroxyl group(s), and 1 secondary alcohol(s). Images of the chemical structure of (R)-4-Chlorobenzhydrol are given below:

The 2D chemical structure image of (R)-4-Chlorobenzhydrol is also called skeletal formula, which is the standard notation for organic molecules. The carbon atoms in the chemical structure of (R)-4-Chlorobenzhydrol 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 (R)-4-Chlorobenzhydrol 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 (R)-4-Chlorobenzhydrol. Download structure data file (SDF/MOL) file of this compound.

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Additional Information for Identifying (R)-4-Chlorobenzhydrol Molecule

• SMILES (Simplified Molecular-Input Line-Entry System) string of (R)-4-Chlorobenzhydrol

  The SMILES string of (R)-4-Chlorobenzhydrol is OC(c1ccccc1)c2ccc(Cl)cc2, which can be can be imported by most molecule editors for conversion back into two-dimensional drawings or three-dimensional models of the (R)-4-Chlorobenzhydrol.

• Structure Data File (SDF/MOL File) of (R)-4-Chlorobenzhydrol

  The structure data file (SDF/MOL File) of (R)-4-Chlorobenzhydrol is available for download in the SDF page of (R)-4-Chlorobenzhydrol, which provides the information about the atoms, bonds, connectivity and coordinates of (R)-4-Chlorobenzhydrol. The (R)-4-Chlorobenzhydrol structure data file can be imported to most of the cheminformatics software systems and applications.

• Chemical formula of (R)-4-Chlorobenzhydrol

  The molecular formula of (R)-4-Chlorobenzhydrol is available in chemical formula page of (R)-4-Chlorobenzhydrol, which identifies each constituent element by its chemical symbol and indicates the proportionate number of atoms of each element.

• Molecular weight of (R)-4-Chlorobenzhydrol

  The molecular weight of (R)-4-Chlorobenzhydrol is available in molecular weight page of (R)-4-Chlorobenzhydrol, 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 (R)-4-Chlorobenzhydrol

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

  • A804316
  • (R)-(4-chlorophenyl)-phenyl-methanol
  • 4-chloro-alpha-phenyl-benzenemethanol
  • 4-chloro-alpha-phenyl-benzenemethano
  • Benzenemethanol, 4-chloro-alpha-phenyl-, (alphaR)-
  • 4-chlorophenyl phenyl carbinol
  • (alphaR)-4-Chloro-alpha-phenylbenzenemethanol
  • 4-Chlorobenzhydrol, (-)-
  • 4-Chlorobenzhydrol, (R)-
  • (-)-4-Chlorobenzhydrol

  • 4-Chlorodiphenylcarbinol
  • 4-Chlorobenzohydrol
  • 123535-85-3
  • (R)-(4-chlorophenyl)-phenylmethanol
  • PA8COP3FYC
  • (R)-4-Chlorobenzhydrol

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(R)-4-Chlorobenzhydrol Identification Summary Frequently Asked Questions (FAQs)

What’s the chemical formula of (R)-4-Chlorobenzhydrol?
C13H11ClO
How many atoms and what are the elements included the (R)-4-Chlorobenzhydrol molecule?
26 atom(s) - 11 Hydrogen atom(s), 13 Carbon atom(s), 1 Oxygen atom(s), and 1 Chlorine atom(s)
How many chemical bonds and what kind of bonds are included the (R)-4-Chlorobenzhydrol structure?
27 bond(s) - 16 non-H bond(s), 12 multiple bond(s), 2 rotatable bond(s), 12 aromatic bond(s), 2 six-membered ring(s), 1 hydroxyl group(s), and 1 secondary alcohol(s)
What’s the (R)-4-Chlorobenzhydrol’s molecular weight?
218.67854 g/mol
What’s the SMILES code of (R)-4-Chlorobenzhydrol?
OC(c1ccccc1)c2ccc(Cl)cc2
What’s the InChI string of (R)-4-Chlorobenzhydrol?
InChI=1S/C13H11ClO/c14-12-8-6-11(7-9-12)13(15)10-4-2-1-3-5-10/h1-9,13,15H/t13-/m1/s1
What’s the InChIKey code of (R)-4-Chlorobenzhydrol?
AJYOOHCNOXWTKJ-CYBMUJFWSA-N

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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).