About 2-(4-methyl-3-methylideneoxolan-2-yl)furan
2-(4-methyl-3-methylideneoxolan-2-yl)furan (PubChem CID 10855826) has the molecular formula C10H12O2
and a molecular weight of 164.20 g/mol. Its IUPAC name is 2-(4-methyl-3-methylideneoxolan-2-yl)furan.
Molecular Properties
| Compound Name | 2-(4-methyl-3-methylideneoxolan-2-yl)furan |
| PubChem CID | 10855826 |
| Molecular Formula | C10H12O2 |
| Molecular Weight | 164.20 g/mol |
| Exact Mass | 164.08 |
| IUPAC Name | 2-(4-methyl-3-methylideneoxolan-2-yl)furan |
| SMILES | C=C1C(C)COC1c1ccco1 |
| InChI | InChI=1S/C10H12O2/c1-7-6-12-10(8(7)2)9-4-3-5-11-9/h3-5,7,10H,2,6H2,1H3 |
| InChIKey | MOIOFBXNIJSHTH-UHFFFAOYSA-N |
| XLogP | 2.54 |
| TPSA | 22.37 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 12 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 164.20 |
| LogP ≤ 5 | 2.54 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 2-(4-methyl-3-methylideneoxolan-2-yl)furan?
The IUPAC name of 2-(4-methyl-3-methylideneoxolan-2-yl)furan (CID 10855826) is 2-(4-methyl-3-methylideneoxolan-2-yl)furan.
What is the SMILES notation for 2-(4-methyl-3-methylideneoxolan-2-yl)furan?
The canonical SMILES for 2-(4-methyl-3-methylideneoxolan-2-yl)furan is C=C1C(C)COC1c1ccco1.
What is the InChIKey of 2-(4-methyl-3-methylideneoxolan-2-yl)furan?
The InChIKey is MOIOFBXNIJSHTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12O2/c1-7-6-12-10(8(7)2)9-4-3-5-11-9/h3-5,7,10H,2,6H2,1H3.
What are the key properties of 2-(4-methyl-3-methylideneoxolan-2-yl)furan?
2-(4-methyl-3-methylideneoxolan-2-yl)furan has a molecular weight of 164.20 g/mol, XLogP of 2.54, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methyl-3-methylideneoxolan-2-yl)furan is sourced from PubChem (CID 10855826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).