About bis(cyclohexane);ethane;propane
bis(cyclohexane);ethane;propane (PubChem CID 91197261) has the molecular formula C20H46
and a molecular weight of 286.59 g/mol. Its IUPAC name is bis(cyclohexane);ethane;propane.
Molecular Properties
| Compound Name | bis(cyclohexane);ethane;propane |
| PubChem CID | 91197261 |
| Molecular Formula | C20H46 |
| Molecular Weight | 286.59 g/mol |
| Exact Mass | 286.36 |
| IUPAC Name | bis(cyclohexane);ethane;propane |
| SMILES | C1CCCCC1.C1CCCCC1.CC.CCC.CCC |
| InChI | InChI=1S/2C6H12.2C3H8.C2H6/c2*1-2-4-6-5-3-1;2*1-3-2;1-2/h2*1-6H2;2*3H2,1-2H3;1-2H3 |
| InChIKey | FHYYJYFEJYDXLJ-UHFFFAOYSA-N |
| XLogP | 8.54 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 286.59 |
| LogP ≤ 5 | 8.54 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
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Frequently Asked Questions
What is the IUPAC name of bis(cyclohexane);ethane;propane?
The IUPAC name of bis(cyclohexane);ethane;propane (CID 91197261) is bis(cyclohexane);ethane;propane.
What is the SMILES notation for bis(cyclohexane);ethane;propane?
The canonical SMILES for bis(cyclohexane);ethane;propane is C1CCCCC1.C1CCCCC1.CC.CCC.CCC.
What is the InChIKey of bis(cyclohexane);ethane;propane?
The InChIKey is FHYYJYFEJYDXLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C6H12.2C3H8.C2H6/c2*1-2-4-6-5-3-1;2*1-3-2;1-2/h2*1-6H2;2*3H2,1-2H3;1-2H3.
What are the key properties of bis(cyclohexane);ethane;propane?
bis(cyclohexane);ethane;propane has a molecular weight of 286.59 g/mol, XLogP of 8.54, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(cyclohexane);ethane;propane is sourced from PubChem (CID 91197261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).