About 2-methyl-2-(2-prop-1-en-2-yloxypropoxy)propane
2-methyl-2-(2-prop-1-en-2-yloxypropoxy)propane (PubChem CID 158148579) has the molecular formula C10H20O2
and a molecular weight of 172.27 g/mol. Its IUPAC name is 2-methyl-2-(2-prop-1-en-2-yloxypropoxy)propane.
Molecular Properties
| Compound Name | 2-methyl-2-(2-prop-1-en-2-yloxypropoxy)propane |
| PubChem CID | 158148579 |
| Molecular Formula | C10H20O2 |
| Molecular Weight | 172.27 g/mol |
| Exact Mass | 172.15 |
| IUPAC Name | 2-methyl-2-(2-prop-1-en-2-yloxypropoxy)propane |
| SMILES | C=C(C)OC(C)COC(C)(C)C |
| InChI | InChI=1S/C10H20O2/c1-8(2)12-9(3)7-11-10(4,5)6/h9H,1,7H2,2-6H3 |
| InChIKey | RVVFSWHNZBVSLC-UHFFFAOYSA-N |
| XLogP | 2.74 |
| TPSA | 18.46 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 12 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 172.27 |
| LogP ≤ 5 | 2.74 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 2-methyl-2-(2-prop-1-en-2-yloxypropoxy)propane?
The IUPAC name of 2-methyl-2-(2-prop-1-en-2-yloxypropoxy)propane (CID 158148579) is 2-methyl-2-(2-prop-1-en-2-yloxypropoxy)propane.
What is the SMILES notation for 2-methyl-2-(2-prop-1-en-2-yloxypropoxy)propane?
The canonical SMILES for 2-methyl-2-(2-prop-1-en-2-yloxypropoxy)propane is C=C(C)OC(C)COC(C)(C)C.
What is the InChIKey of 2-methyl-2-(2-prop-1-en-2-yloxypropoxy)propane?
The InChIKey is RVVFSWHNZBVSLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O2/c1-8(2)12-9(3)7-11-10(4,5)6/h9H,1,7H2,2-6H3.
What are the key properties of 2-methyl-2-(2-prop-1-en-2-yloxypropoxy)propane?
2-methyl-2-(2-prop-1-en-2-yloxypropoxy)propane has a molecular weight of 172.27 g/mol, XLogP of 2.74, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-(2-prop-1-en-2-yloxypropoxy)propane is sourced from PubChem (CID 158148579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).