Molecular Weight of Gluconolactone (C6H10O6)
Identification of Gluconolactone Chemical Compound
Chemical Formula | C6H10O6 |
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Molecular Weight | 178.14 g/mol |
IUPAC Name | (3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-one |
SMILES String | OCC1OC(=O)C(O)C(O)C1O |
InChI | InChI=1S/C6H10O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-5,7-10H,1H2/t2-,3-,4+,5-/m1/s1 |
InChIKey | PHOQVHQSTUBQQK-SQOUGZDYSA-N |
Molecular Weight Description
The gluconolactone molecule consists of 10 Hydrogen atom(s), 6 Carbon atom(s), and 6 Oxygen atom(s) - a total of 22 atom(s). The molecular weight of gluconolactone is determined by the sum of the atomic weights of each constituent element multiplied by the number of atoms, which is calculated to be:
$$ 178.14 · \frac{g}{mol} $$
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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- CAS #: 64-17-5
- Formula: C2H5OH
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- InChI: InChI=1S/C2H6O/c1-2-3/h3H,2H2,1H3
- InChIKey: LFQSCWFLJHTTHZ-UHFFFAOYSA-N
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Additional Information for Identifying Gluconolactone Molecule
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Structure Data File (SDF/MOL File) of gluconolactone
The structure data file (SDF/MOL File) of gluconolactone is available for download in the SDF page of gluconolactone, which provides the information on atoms, bonds, connectivity and coordinates of gluconolactone. The gluconolactone 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 gluconolactone
The molecular structure image of gluconolactone is available in chemical structure page of gluconolactone, which provides the molecular geometry information, i.e., the spatial arrangement of atoms in gluconolactone and the chemical bonds that hold the atoms together.
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Chemical formula of gluconolactone
The molecular formula of gluconolactone is given in chemical formula page of gluconolactone, 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 gluconolactone
In addition to the molecular weight information, the structural information of gluconolactone in a textual expression is available via InChi. The full standard InChI of gluconolactone is given below:
InChI=1S/C6H10O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-5,7-10H,1H2/t2-,3-,4+,5-/m1/s1
It can provide a way to encode the molecular information of gluconolactone 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 gluconolactone is:
InChIKey=PHOQVHQSTUBQQK-SQOUGZDYSA-N
It may allow easier web searches for gluconolactone. The InChIKey, however, needs to be linked to the full InChI as well in order to get back to the original structure of the gluconolactone as the full standard InChI cannot be reconstructed from the InChIKey.
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Other names (synonyms) or registry numbers of gluconolactone
There may be different names of the gluconolactone compound depending on the various situations of industrial applications, which are given below including the registry numbers if available:
- Glucarolactone
- (3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-one
- Gluconolactone (USP)
- D04332
- delta-D-Gluconolactone
- beta-Glucono-1,5-lactone
- Glucono delta-lactone
- Glucono delta lactone
- Gluconic delta-lactone
- Gluconic acid, delta-lactone, D-
- Gluconic acid lactone (6CI)
- Deltagluconolactone
- D-delta-Gluconolactone
- D-Gluconic delta-lactone
- D-Gluconic acid-delta-lactone
- D-Gluconic acid, delta-lactone
- D-Gluconic acid lactone
- D-Gluconic acid delta-lactone
- 1,5-D-Gluconolactone
- D-()-Gluconic acid delta-lactone
- D-()-Dextronic acid delta-lactone
- 1,2,3,4,5-Pentahydroxycaproic acid delta-lactone
- LGC
- (3S,4R,5R,6S)-3,4,5-TRIHYDROXY-6-(HYDROXYMETHYL)TETRAHYDRO-2H-PYRAN-2-ONE
- 71033-49-3
- 4253-68-3
- 1335-57-5
- (3R,4S,5S,6R)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-one
- (3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranone
- (3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-one
- D-threo-Aldono-1,5-lactone
- D-Aldonolactone
- Gluconolactone
Gluconolactone Identification Summary Frequently Asked Questions (FAQs)
What’s the formula of gluconolactone? |
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C6H10O6 |
How many atoms and what are the elements in the gluconolactone molecule? |
22 atom(s) - 10 Hydrogen atom(s), 6 Carbon atom(s), and 6 Oxygen atom(s) |
How many chemical bonds and what types of bonds are in the gluconolactone structure? |
22 bond(s) - 12 non-H bond(s), 1 multiple bond(s), 1 rotatable bond(s), 1 double bond(s), 1 six-membered ring(s), 1 ester(s) (aliphatic), 4 hydroxyl group(s), 1 primary alcohol(s), and 3 secondary alcohol(s) |
What’s the molar mass of gluconolactone? |
178.14 g/mol |
What’s the SMILES format of gluconolactone? |
OCC1OC(=O)C(O)C(O)C1O |
What’s the InChI format of gluconolactone? |
InChI=1S/C6H10O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-5,7-10H,1H2/t2-,3-,4+,5-/m1/s1 |
What’s the InChIKey string of gluconolactone? |
PHOQVHQSTUBQQK-SQOUGZDYSA-N |
1211
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).