Molecular Weight of Allylcyclopentane (C8H14)
Identification of Allylcyclopentane Chemical Compound
| Chemical Formula | C8H14 |
|---|---|
| Molecular Weight | 110.19676 g/mol |
| IUPAC Name | prop-2-en-1-ylcyclopentane |
| SMILES String | C=CCC1CCCC1 |
| InChI | InChI=1S/C8H14/c1-2-5-8-6-3-4-7-8/h2,8H,1,3-7H2 |
| InChIKey | NHIDGVQVYHCGEK-UHFFFAOYSA-N |
Molecular Weight Description
The Allylcyclopentane molecule consists of 14 Hydrogen atom(s) and 8 Carbon atom(s) - a total of 22 atom(s). The molecular weight of Allylcyclopentane is determined by the sum of the atomic weights of each constituent element multiplied by the number of atoms, which is calculated to be:
$$ 110.19676 · \frac{g}{mol} $$
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
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- InChIKey: LFQSCWFLJHTTHZ-UHFFFAOYSA-N
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Additional Information for Identifying Allylcyclopentane Molecule
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Structure Data File (SDF/MOL File) of Allylcyclopentane
The structure data file (SDF/MOL File) of Allylcyclopentane is available for download in the SDF page of Allylcyclopentane, which provides the information on atoms, bonds, connectivity and coordinates of Allylcyclopentane. The Allylcyclopentane 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 Allylcyclopentane
The molecular structure image of Allylcyclopentane is available in chemical structure page of Allylcyclopentane, which provides the molecular geometry information, i.e., the spatial arrangement of atoms in Allylcyclopentane and the chemical bonds that hold the atoms together.
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Chemical formula of Allylcyclopentane
The molecular formula of Allylcyclopentane is given in chemical formula page of Allylcyclopentane, 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 Allylcyclopentane
In addition to the molecular weight information, the structural information of Allylcyclopentane in a textual expression is available via InChi. The full standard InChI of Allylcyclopentane is given below:
InChI=1S/C8H14/c1-2-5-8-6-3-4-7-8/h2,8H,1,3-7H2
It can provide a way to encode the molecular information of Allylcyclopentane 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 Allylcyclopentane is:
InChIKey=NHIDGVQVYHCGEK-UHFFFAOYSA-N
It may allow easier web searches for Allylcyclopentane. The InChIKey, however, needs to be linked to the full InChI as well in order to get back to the original structure of the Allylcyclopentane as the full standard InChI cannot be reconstructed from the InChIKey.
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Other names (synonyms) or registry numbers of Allylcyclopentane
There may be different names of the Allylcyclopentane compound depending on the various situations of industrial applications, which are given below including the registry numbers if available:
- BBV-39687399
- AR-1H6822
- I14-60860
- MFCD00001390
- 2-propen-1-ylcyclopentane
- (2-Propenyl)cyclopentane
- Allylcyclopentane, 97%
- Prop-2-enylcyclopentane
- 3-cyclopentylprop-1-ene
- 1-Propene, 3-cyclopentyl-
- 2-Propenylcyclopentane
- Allyl cyclopentane
- Cyclopentane, 2-propenyl-
- 3-Cyclopentyl-1-propene
- Cyclopentane, allyl-
- 3524-75-2
- 3-Cyclopentylpropene
- Allylcyclopentane
Allylcyclopentane Identification Summary Frequently Asked Questions (FAQs)
| What’s the formula of Allylcyclopentane? |
|---|
| C8H14 |
| How many atoms and what are the elements in the Allylcyclopentane molecule? |
| 22 atom(s) - 14 Hydrogen atom(s) and 8 Carbon atom(s) |
| How many chemical bonds and what types of bonds are in the Allylcyclopentane structure? |
| 22 bond(s) - 8 non-H bond(s), 1 multiple bond(s), 2 rotatable bond(s), 1 double bond(s), and 1 five-membered ring(s) |
| What’s the molar mass of Allylcyclopentane? |
| 110.19676 g/mol |
| What’s the SMILES format of Allylcyclopentane? |
| C=CCC1CCCC1 |
| What’s the InChI format of Allylcyclopentane? |
| InChI=1S/C8H14/c1-2-5-8-6-3-4-7-8/h2,8H,1,3-7H2 |
| What’s the InChIKey string of Allylcyclopentane? |
| NHIDGVQVYHCGEK-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).