Formula of ETHANE (C2H6)
Identification of ETHANE Chemical Compound
Chemical Formula | C2H6 |
---|---|
Molecular Weight | 30.06904 g/mol |
IUPAC Name | ethane |
SMILES String | CC |
InChI | InChI=1S/C2H6/c1-2/h1-2H3 |
InChIKey | OTMSDBZUPAUEDD-UHFFFAOYSA-N |
Chemical Formula Description
The ETHANE molecule contains a total of 8 atom(s). There are 6 Hydrogen atom(s) and 2 Carbon atom(s). A chemical formula of ETHANE can therefore be written as:
C2H6
The chemical formula of ETHANE shown above is based on the molecular formula indicating the numbers of each type of atom in a molecule without structural information, which is different from the empirical formula which provides the numerical proportions of atoms of each type.
The above chemical formula is the basis of stoichiometry in chemical equations, i.e., the calculation of relative quantities of reactants and products in chemical reactions. The law of conservation of mass dictates that the quantity of each element given in the chemical formula does not change in a chemical reaction. Thus, each side of the chemical equation must represent the same quantity of any particular element based on the chemical formula.
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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
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Additional Information for Identifying ETHANE Molecule
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Structure Data File (SDF/MOL File) of ETHANE
The structure data file (SDF/MOL File) of ETHANE is available for download in the SDF page of ETHANE providing the information about the atoms, bonds, connectivity and coordinates of ETHANE, which is not completely available in the chemical formula representation. The ETHANE structure data file can be imported to most of the cheminformatics software for further analysis and visualization.
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Chemical structure of ETHANE
The chemical structure image of ETHANE is available in chemical structure page of ETHANE, which specifies the molecular geometry, i.e., the spatial arrangement of atoms in the chemical formula of ETHANE and the chemical bonds that hold the atoms together.
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Molecular weight of ETHANE
The molecular weight of ETHANE is available in molecular weight page of ETHANE, which is calculated as the sum of the atomic weights of each constituent element multiplied by the number of atoms of that element specified in the chemical formula of ETHANE.
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InChI (IUPAC International Chemical Identifier) information of ETHANE
The molecular chemical formulas lack structural information. An alternative textual expression including the structural information is InChI. The full standard InChI of ETHANE is:
InChI=1S/C2H6/c1-2/h1-2H3
It can provide a standard way to encode the molecular information of ETHANE 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 ETHANE is:
InChIKey=OTMSDBZUPAUEDD-UHFFFAOYSA-N
The InChIKey may allow easier web searches for ETHANE, but it needs to be linked to the full InChI to get back to the original structure of the ETHANE since the full standard InChI cannot be reconstructed from the InChIKey.
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Other names (synonyms) or registry numbers of ETHANE
The ETHANE compound may have different names depending on the various different situations of industrial applications. The list of the other names (synonyms) of ETHANE including the registry numbers is given below, if available:
- AR-1I7307
- EHN
- Ethane, refrigerated liquid [UN1961] [Flammable gas]
- Ethane, refrigerated liquid [UN1961] [Flammable gas]
- B89E451F-F83E-471B-8B27-36FC23EF5CA1
- I14-54140
- S-6468
- R-170
- Ethane, Messer(R) CANGas, 99.95%
- UN 1961
- UN 1035
- Ethane [UN1035] [Flammable gas]
- MFCD00009023
- Ethane [UN1035] [Flammable gas]
- 1,1,1,2,2,2-Ethanehexaylradical
- Ethane, >=99.95% (GC)
- L99N5N533T
- CH3-CH3
- CH3-CH2
- Ethane, refrigerated liquid
- Ethane, 99.99%
- Ethane, >=99%
- Ethylidyne radical
- Liquid overheads
- Aethan
- Alkanes, C2-3
- OET
- Ethyl Group
- C2H6
- Ethan
- 74-84-0
- Ethyl hydride
- Methylmethane
- Dimethyl
- Bimethyl
- 68475-58-1
ETHANE Identification Summary Frequently Asked Questions (FAQs)
What’s the chemical formula of ETHANE? |
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C2H6 |
How many atoms and what are they in the ETHANE structure? |
8 atom(s) - 6 Hydrogen atom(s) and 2 Carbon atom(s) |
How many chemical bonds and what are they in the ETHANE structure? |
7 bond(s) - 1 non-H bond(s) |
What’s the molecular weight of ETHANE? |
30.06904 g/mol |
What’s the SMILES string of ETHANE? |
CC |
What’s the InChI of ETHANE? |
InChI=1S/C2H6/c1-2/h1-2H3 |
What’s the InChIKey of ETHANE? |
OTMSDBZUPAUEDD-UHFFFAOYSA-N |
2678
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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).