Molecular Weight of Cannabifuran (C21H26O2)
Identification of Cannabifuran Chemical Compound
| Chemical Formula | C21H26O2 |
|---|---|
| Molecular Weight | 310.42994 g/mol |
| IUPAC Name | 10-methyl-5-pentyl-13-(propan-2-yl)-8-oxatricyclo[7.4.0.0^{2,7}]trideca-1(13),2(7),3,5,9,11-hexaen-3-ol |
| SMILES String | CCCCCc1cc(O)c2c(c1)oc3c(C)ccc(C(C)C)c23 |
| InChI | InChI=1S/C21H26O2/c1-5-6-7-8-15-11-17(22)20-18(12-15)23-21-14(4)9-10-16(13(2)3)19(20)21/h9-13,22H,5-8H2,1-4H3 |
| InChIKey | VNGQMWZHHNCMLQ-UHFFFAOYSA-N |
Molecular Weight Description
The Cannabifuran molecule consists of 26 Hydrogen atom(s), 21 Carbon atom(s), and 2 Oxygen atom(s) - a total of 49 atom(s). The molecular weight of Cannabifuran is determined by the sum of the atomic weights of each constituent element multiplied by the number of atoms, which is calculated to be:
$$ 310.42994 · \frac{g}{mol} $$
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 Cannabifuran Molecule
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Structure Data File (SDF/MOL File) of Cannabifuran
The structure data file (SDF/MOL File) of Cannabifuran is available for download in the SDF page of Cannabifuran, which provides the information on atoms, bonds, connectivity and coordinates of Cannabifuran. The Cannabifuran 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 Cannabifuran
The molecular structure image of Cannabifuran is available in chemical structure page of Cannabifuran, which provides the molecular geometry information, i.e., the spatial arrangement of atoms in Cannabifuran and the chemical bonds that hold the atoms together.
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Chemical formula of Cannabifuran
The molecular formula of Cannabifuran is given in chemical formula page of Cannabifuran, 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 Cannabifuran
In addition to the molecular weight information, the structural information of Cannabifuran in a textual expression is available via InChi. The full standard InChI of Cannabifuran is given below:
InChI=1S/C21H26O2/c1-5-6-7-8-15-11-17(22)20-18(12-15)23-21-14(4)9-10-16(13(2)3)19(20)21/h9-13,22H,5-8H2,1-4H3
It can provide a way to encode the molecular information of Cannabifuran 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 Cannabifuran is:
InChIKey=VNGQMWZHHNCMLQ-UHFFFAOYSA-N
It may allow easier web searches for Cannabifuran. The InChIKey, however, needs to be linked to the full InChI as well in order to get back to the original structure of the Cannabifuran as the full standard InChI cannot be reconstructed from the InChIKey.
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Other names (synonyms) or registry numbers of Cannabifuran
There may be different names of the Cannabifuran compound depending on the various situations of industrial applications, which are given below including the registry numbers if available:
- 56154-58-6
- Cannabifuran
Cannabifuran Identification Summary Frequently Asked Questions (FAQs)
| What’s the formula of Cannabifuran? |
|---|
| C21H26O2 |
| How many atoms and what are the elements in the Cannabifuran molecule? |
| 49 atom(s) - 26 Hydrogen atom(s), 21 Carbon atom(s), and 2 Oxygen atom(s) |
| How many chemical bonds and what types of bonds are in the Cannabifuran structure? |
| 51 bond(s) - 25 non-H bond(s), 15 multiple bond(s), 5 rotatable bond(s), 15 aromatic bond(s), 1 five-membered ring(s), 2 six-membered ring(s), 2 nine-membered ring(s), 1 aromatic hydroxyl(s), and 1 Furane(s) |
| What’s the molar mass of Cannabifuran? |
| 310.42994 g/mol |
| What’s the SMILES format of Cannabifuran? |
| CCCCCc1cc(O)c2c(c1)oc3c(C)ccc(C(C)C)c23 |
| What’s the InChI format of Cannabifuran? |
| InChI=1S/C21H26O2/c1-5-6-7-8-15-11-17(22)20-18(12-15)23-21-14(4)9-10-16(13(2)3)19(20)21/h9-13,22H,5-8H2,1-4H3 |
| What’s the InChIKey string of Cannabifuran? |
| VNGQMWZHHNCMLQ-UHFFFAOYSA-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).