About 6aH-cyclopenta[b]furan-3-one
6aH-cyclopenta[b]furan-3-one (PubChem CID 54150528) has the molecular formula C7H6O2
and a molecular weight of 122.12 g/mol. Its IUPAC name is 6aH-cyclopenta[b]furan-3-one.
Molecular Properties
| Compound Name | 6aH-cyclopenta[b]furan-3-one |
|---|
| PubChem CID | 54150528 |
|---|
| Molecular Formula | C7H6O2 |
|---|
| Molecular Weight | 122.12 g/mol |
|---|
| Exact Mass | 122.04 |
|---|
| IUPAC Name | 6aH-cyclopenta[b]furan-3-one |
|---|
| SMILES | O=C1COC2C=CC=C12 |
|---|
| InChI | InChI=1S/C7H6O2/c8-6-4-9-7-3-1-2-5(6)7/h1-3,7H,4H2 |
|---|
| InChIKey | OHKHJCLQWKJMLD-UHFFFAOYSA-N |
|---|
| XLogP | 0.45 |
|---|
| TPSA | 26.30 Ų |
|---|
| H-Bond Donors | |
|---|
| H-Bond Acceptors | 2 |
|---|
| Rotatable Bonds | |
|---|
| Heavy Atoms | 9 |
|---|
| Complexity | — |
|---|
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
|---|
| MW ≤ 500 | 122.12 |
| LogP ≤ 5 | 0.45 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
Analyze 6aH-cyclopenta[b]furan-3-one with MolForge
Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.
Launch Full Analysis
Frequently Asked Questions
What is the IUPAC name of 6aH-cyclopenta[b]furan-3-one?
The IUPAC name of 6aH-cyclopenta[b]furan-3-one (CID 54150528) is 6aH-cyclopenta[b]furan-3-one.
What is the SMILES notation for 6aH-cyclopenta[b]furan-3-one?
The canonical SMILES for 6aH-cyclopenta[b]furan-3-one is O=C1COC2C=CC=C12.
What is the InChIKey of 6aH-cyclopenta[b]furan-3-one?
The InChIKey is OHKHJCLQWKJMLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6O2/c8-6-4-9-7-3-1-2-5(6)7/h1-3,7H,4H2.
What are the key properties of 6aH-cyclopenta[b]furan-3-one?
6aH-cyclopenta[b]furan-3-one has a molecular weight of 122.12 g/mol, XLogP of 0.45, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6aH-cyclopenta[b]furan-3-one is sourced from PubChem (CID 54150528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).