Molecular Weight of L-Gluconic acid (C6H12O7)
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| Chemical Formula | C6H12O7 |
|---|---|
| Molecular Weight | 196.15528 g/mol |
| IUPAC Name | (2S,3R,4S,5S)-2,3,4,5,6-pentahydroxyhexanoic acid |
| SMILES String | OCC(O)C(O)C(O)C(O)C(O)=O |
| InChI | InChI=1S/C6H12O7/c7-1-2(8)3(9)4(10)5(11)6(12)13/h2-5,7-11H,1H2,(H,12,13)/t2-,3-,4+,5-/m0/s1 |
| InChIKey | RGHNJXZEOKUKBD-KLVWXMOXSA-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. |
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Molecular Weight Description
The L-Gluconic acid molecule consists of 12 Hydrogen atom(s), 6 Carbon atom(s), and 7 Oxygen atom(s) - a total of 25 atom(s). The molecular weight of L-Gluconic acid is determined by the sum of the atomic weights of each constituent element multiplied by the number of atoms, which is calculated to be:
$$ 196.15528 · \frac{g}{mol} $$
The exact term of the above molecular weight is “molar mass”, which is based on the atomic mass of each element. Molecular weight is actually an older term of “relative molar mass” or “molecular mass”, which is a dimensionless quantity equal to the molar mass divided by the molar mass constant defined by 1 g/mol.
Molecular masses are calculated from the standard atomic weights of each nuclide, while molar masses are calculated from the atomic mass of each element. The atomic mass takes into account the isotopic distribution of the element in a given sample.
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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 L-Gluconic acid Molecule
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Structure Data File (SDF/MOL File) of L-Gluconic acid
The structure data file (SDF/MOL File) of L-Gluconic acid is available for download in the SDF page of L-Gluconic acid, which provides the information on atoms, bonds, connectivity and coordinates of L-Gluconic acid. The L-Gluconic acid structure data file can be imported to most of the chemistry-related software, providing three-dimensional visualization and further analysis.
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Chemical structure of L-Gluconic acid
The molecular structure image of L-Gluconic acid is available in chemical structure page of L-Gluconic acid, which provides the molecular geometry information, i.e., the spatial arrangement of atoms in L-Gluconic acid and the chemical bonds that hold the atoms together.
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Chemical formula of L-Gluconic acid
The molecular formula of L-Gluconic acid is given in chemical formula page of L-Gluconic acid, which identifies each constituent element by its chemical symbol and indicates the proportionate number of atoms of each element.
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InChI (IUPAC International Chemical Identifier) information of L-Gluconic acid
In addition to the molecular weight information, the structural information of L-Gluconic acid in a textual expression is available via InChi. The full standard InChI of L-Gluconic acid is given below:
InChI=1S/C6H12O7/c7-1-2(8)3(9)4(10)5(11)6(12)13/h2-5,7-11H,1H2,(H,12,13)/t2-,3-,4+,5-/m0/s1
It can provide a way to encode the molecular information of L-Gluconic acid to facilitate the search for the compound information in databases and on the web.
The condensed, 27 character standard InChIKey (hashed version of the full standard InChI) of L-Gluconic acid is:
InChIKey=RGHNJXZEOKUKBD-KLVWXMOXSA-N
It may allow easier web searches for L-Gluconic acid. The InChIKey, however, needs to be linked to the full InChI as well in order to get back to the original structure of the L-Gluconic acid as the full standard InChI cannot be reconstructed from the InChIKey.
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Other names (synonyms) or registry numbers of L-Gluconic acid
There may be different names of the L-Gluconic acid compound depending on the various situations of industrial applications, which are given below including the registry numbers if available:
- L-Gluconic acid
L-Gluconic acid Identification Summary Frequently Asked Questions (FAQs)
| What’s the formula of L-Gluconic acid? |
|---|
| C6H12O7 |
| How many atoms and what are the elements in the L-Gluconic acid molecule? |
| 25 atom(s) - 12 Hydrogen atom(s), 6 Carbon atom(s), and 7 Oxygen atom(s) |
| How many chemical bonds and what types of bonds are in the L-Gluconic acid structure? |
| 24 bond(s) - 12 non-H bond(s), 1 multiple bond(s), 5 rotatable bond(s), 1 double bond(s), 1 carboxylic acid(s) (aliphatic), 6 hydroxyl group(s), 1 primary alcohol(s), and 4 secondary alcohol(s) |
| What’s the molar mass of L-Gluconic acid? |
| 196.15528 g/mol |
| What’s the SMILES format of L-Gluconic acid? |
| OCC(O)C(O)C(O)C(O)C(O)=O |
| What’s the InChI format of L-Gluconic acid? |
| InChI=1S/C6H12O7/c7-1-2(8)3(9)4(10)5(11)6(12)13/h2-5,7-11H,1H2,(H,12,13)/t2-,3-,4+,5-/m0/s1 |
| What’s the InChIKey string of L-Gluconic acid? |
| RGHNJXZEOKUKBD-KLVWXMOXSA-N |