About methane;tris(2-methyl-2-propoxypropane)
methane;tris(2-methyl-2-propoxypropane) (PubChem CID 160767059) has the molecular formula C22H52O3
and a molecular weight of 364.66 g/mol. Its IUPAC name is methane;tris(2-methyl-2-propoxypropane).
Molecular Properties
| Compound Name | methane;tris(2-methyl-2-propoxypropane) |
| PubChem CID | 160767059 |
| Molecular Formula | C22H52O3 |
| Molecular Weight | 364.66 g/mol |
| Exact Mass | 364.39 |
| IUPAC Name | methane;tris(2-methyl-2-propoxypropane) |
| SMILES | C.CCCOC(C)(C)C.CCCOC(C)(C)C.CCCOC(C)(C)C |
| InChI | InChI=1S/3C7H16O.CH4/c3*1-5-6-8-7(2,3)4;/h3*5-6H2,1-4H3;1H4 |
| InChIKey | RYUWPJVYVICGEY-UHFFFAOYSA-N |
| XLogP | 7.27 |
| TPSA | 27.69 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 25 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 364.66 |
| LogP ≤ 5 | 7.27 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of methane;tris(2-methyl-2-propoxypropane)?
The IUPAC name of methane;tris(2-methyl-2-propoxypropane) (CID 160767059) is methane;tris(2-methyl-2-propoxypropane).
What is the SMILES notation for methane;tris(2-methyl-2-propoxypropane)?
The canonical SMILES for methane;tris(2-methyl-2-propoxypropane) is C.CCCOC(C)(C)C.CCCOC(C)(C)C.CCCOC(C)(C)C.
What is the InChIKey of methane;tris(2-methyl-2-propoxypropane)?
The InChIKey is RYUWPJVYVICGEY-UHFFFAOYSA-N. The full InChI is InChI=1S/3C7H16O.CH4/c3*1-5-6-8-7(2,3)4;/h3*5-6H2,1-4H3;1H4.
What are the key properties of methane;tris(2-methyl-2-propoxypropane)?
methane;tris(2-methyl-2-propoxypropane) has a molecular weight of 364.66 g/mol, XLogP of 7.27, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methane;tris(2-methyl-2-propoxypropane) is sourced from PubChem (CID 160767059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).