About 4-ethyl-2-(methoxymethyl)thiophene
4-ethyl-2-(methoxymethyl)thiophene (PubChem CID 145483599) has the molecular formula C8H12OS
and a molecular weight of 156.25 g/mol. Its IUPAC name is 4-ethyl-2-(methoxymethyl)thiophene.
Molecular Properties
| Compound Name | 4-ethyl-2-(methoxymethyl)thiophene |
| PubChem CID | 145483599 |
| Molecular Formula | C8H12OS |
| Molecular Weight | 156.25 g/mol |
| Exact Mass | 156.06 |
| IUPAC Name | 4-ethyl-2-(methoxymethyl)thiophene |
| SMILES | CCc1csc(COC)c1 |
| InChI | InChI=1S/C8H12OS/c1-3-7-4-8(5-9-2)10-6-7/h4,6H,3,5H2,1-2H3 |
| InChIKey | FPINIOMQOBPWNI-UHFFFAOYSA-N |
| XLogP | 2.46 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 10 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 156.25 |
| LogP ≤ 5 | 2.46 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 4-ethyl-2-(methoxymethyl)thiophene?
The IUPAC name of 4-ethyl-2-(methoxymethyl)thiophene (CID 145483599) is 4-ethyl-2-(methoxymethyl)thiophene.
What is the SMILES notation for 4-ethyl-2-(methoxymethyl)thiophene?
The canonical SMILES for 4-ethyl-2-(methoxymethyl)thiophene is CCc1csc(COC)c1.
What is the InChIKey of 4-ethyl-2-(methoxymethyl)thiophene?
The InChIKey is FPINIOMQOBPWNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12OS/c1-3-7-4-8(5-9-2)10-6-7/h4,6H,3,5H2,1-2H3.
What are the key properties of 4-ethyl-2-(methoxymethyl)thiophene?
4-ethyl-2-(methoxymethyl)thiophene has a molecular weight of 156.25 g/mol, XLogP of 2.46, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-(methoxymethyl)thiophene is sourced from PubChem (CID 145483599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).