Structure of Trans-Cyclohexane-1,2-diol (C6H12O2)
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Chemical Formula | C6H12O2 |
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Molecular Weight | 116.15828 g/mol |
IUPAC Name | (1R,2R)-cyclohexane-1,2-diol |
SMILES String | OC1CCCCC1O |
InChI | InChI=1S/C6H12O2/c7-5-3-1-2-4-6(5)8/h5-8H,1-4H2/t5-,6-/m1/s1 |
InChIKey | PFURGBBHAOXLIO-PHDIDXHHSA-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 trans-Cyclohexane-1,2-diol molecule contains a total of 20 bond(s). There are 8 non-H bond(s), 1 six-membered ring(s), 2 hydroxyl group(s), and 2 secondary alcohol(s). Images of the chemical structure of trans-Cyclohexane-1,2-diol are given below:
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
The 2D chemical structure image of trans-Cyclohexane-1,2-diol is also called skeletal formula, which is the standard notation for organic molecules. The carbon atoms in the chemical structure of trans-Cyclohexane-1,2-diol 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 trans-Cyclohexane-1,2-diol 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 trans-Cyclohexane-1,2-diol. 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 trans-Cyclohexane-1,2-diol is provided here.
The trans-Cyclohexane-1,2-diol 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 trans-Cyclohexane-1,2-diol 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 trans-Cyclohexane-1,2-diol 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
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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 Trans-Cyclohexane-1,2-diol Molecule
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SMILES (Simplified Molecular-Input Line-Entry System) string of trans-Cyclohexane-1,2-diol
The SMILES string of trans-Cyclohexane-1,2-diol is OC1CCCCC1O, which can be can be imported by most molecule editors for conversion back into two-dimensional drawings or three-dimensional models of the trans-Cyclohexane-1,2-diol.
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Structure Data File (SDF/MOL File) of trans-Cyclohexane-1,2-diol
The structure data file (SDF/MOL File) of trans-Cyclohexane-1,2-diol is available for download in the SDF page of trans-Cyclohexane-1,2-diol, which provides the information about the atoms, bonds, connectivity and coordinates of trans-Cyclohexane-1,2-diol. The trans-Cyclohexane-1,2-diol structure data file can be imported to most of the cheminformatics software systems and applications.
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Chemical formula of trans-Cyclohexane-1,2-diol
The molecular formula of trans-Cyclohexane-1,2-diol is available in chemical formula page of trans-Cyclohexane-1,2-diol, which identifies each constituent element by its chemical symbol and indicates the proportionate number of atoms of each element.
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Molecular weight of trans-Cyclohexane-1,2-diol
The molecular weight of trans-Cyclohexane-1,2-diol is available in molecular weight page of trans-Cyclohexane-1,2-diol, 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.
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Other names (synonyms) or registry numbers of trans-Cyclohexane-1,2-diol
The trans-Cyclohexane-1,2-diol compound may be called differently depending on the various different situations of industrial applications. Below are the list of the other names (synonyms) of trans-Cyclohexane-1,2-diol including the various registry numbers, if available:
- AR-1J2920
- (1R,2R)-trans-1,2-Cyclohexanediol, puriss., >=99.0% (sum of enantiomers, GC)
- Z2492408401
- ( inverted exclamation markA)-trans-1,2-Cyclohexanediol
- W-108130
- J-001751
- M-7494
- Z4171
- (1R,2R)-trans-1,2-Cyclohexanediol, 99%
- RTR-005771
- rel-(1R,2R)-cyclohexane-1,2-diol
- ANW-20984
- 8364AH
- trans-1,2-Cyclohexanediol, 98%
- 1,2-Cyclohexanediol,(1R,2R)-
- (1R)-trans-1,2-Cyclohexanediol
- BDBM36071
- (1R,2R)cyclohexane-1,2-diol
- (1r,2r)-1,2-cyclohexanediol
- l6tj aq bq&&trans
- 1,2-Cyclohexanediol, trans-
- trans-1,2-Dihydroxycyclohexane
- 1,2-Cyclohexanediol, (1R,2R)-rel-
- (1R,2R)-trans-1,2-Cyclohexanediol
- 1072-86-2
- trans-1,2-Cyclohexanediol
- 1460-57-7
- trans-Cyclohexane-1,2-diol
Trans-Cyclohexane-1,2-diol Identification Summary Frequently Asked Questions (FAQs)
What’s the chemical formula of trans-Cyclohexane-1,2-diol? |
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C6H12O2 |
How many atoms and what are the elements included the trans-Cyclohexane-1,2-diol molecule? |
20 atom(s) - 12 Hydrogen atom(s), 6 Carbon atom(s), and 2 Oxygen atom(s) |
How many chemical bonds and what kind of bonds are included the trans-Cyclohexane-1,2-diol structure? |
20 bond(s) - 8 non-H bond(s), 1 six-membered ring(s), 2 hydroxyl group(s), and 2 secondary alcohol(s) |
What’s the trans-Cyclohexane-1,2-diol’s molecular weight? |
116.15828 g/mol |
What’s the SMILES code of trans-Cyclohexane-1,2-diol? |
OC1CCCCC1O |
What’s the InChI string of trans-Cyclohexane-1,2-diol? |
InChI=1S/C6H12O2/c7-5-3-1-2-4-6(5)8/h5-8H,1-4H2/t5-,6-/m1/s1 |
What’s the InChIKey code of trans-Cyclohexane-1,2-diol? |
PFURGBBHAOXLIO-PHDIDXHHSA-N |