About 3-fluoro-2-(3-fluoroprop-1-en-2-yloxy)prop-1-ene
3-fluoro-2-(3-fluoroprop-1-en-2-yloxy)prop-1-ene (PubChem CID 23369119) has the molecular formula C6H8F2O
and a molecular weight of 134.12 g/mol. Its IUPAC name is 3-fluoro-2-(3-fluoroprop-1-en-2-yloxy)prop-1-ene.
Molecular Properties
| Compound Name | 3-fluoro-2-(3-fluoroprop-1-en-2-yloxy)prop-1-ene |
| PubChem CID | 23369119 |
| Molecular Formula | C6H8F2O |
| Molecular Weight | 134.12 g/mol |
| Exact Mass | 134.05 |
| IUPAC Name | 3-fluoro-2-(3-fluoroprop-1-en-2-yloxy)prop-1-ene |
| SMILES | C=C(CF)OC(=C)CF |
| InChI | InChI=1S/C6H8F2O/c1-5(3-7)9-6(2)4-8/h1-4H2 |
| InChIKey | ITLLIOXWJBYHEZ-UHFFFAOYSA-N |
| XLogP | 1.97 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 9 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 134.12 |
| LogP ≤ 5 | 1.97 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
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 3-fluoro-2-(3-fluoroprop-1-en-2-yloxy)prop-1-ene?
The IUPAC name of 3-fluoro-2-(3-fluoroprop-1-en-2-yloxy)prop-1-ene (CID 23369119) is 3-fluoro-2-(3-fluoroprop-1-en-2-yloxy)prop-1-ene.
What is the SMILES notation for 3-fluoro-2-(3-fluoroprop-1-en-2-yloxy)prop-1-ene?
The canonical SMILES for 3-fluoro-2-(3-fluoroprop-1-en-2-yloxy)prop-1-ene is C=C(CF)OC(=C)CF.
What is the InChIKey of 3-fluoro-2-(3-fluoroprop-1-en-2-yloxy)prop-1-ene?
The InChIKey is ITLLIOXWJBYHEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8F2O/c1-5(3-7)9-6(2)4-8/h1-4H2.
What are the key properties of 3-fluoro-2-(3-fluoroprop-1-en-2-yloxy)prop-1-ene?
3-fluoro-2-(3-fluoroprop-1-en-2-yloxy)prop-1-ene has a molecular weight of 134.12 g/mol, XLogP of 1.97, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-2-(3-fluoroprop-1-en-2-yloxy)prop-1-ene is sourced from PubChem (CID 23369119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).