About 1-fluoro-1-iodo-2-methylprop-1-ene
1-fluoro-1-iodo-2-methylprop-1-ene (PubChem CID 118348659) has the molecular formula C4H6FI
and a molecular weight of 199.99 g/mol. Its IUPAC name is 1-fluoro-1-iodo-2-methylprop-1-ene.
Molecular Properties
| Compound Name | 1-fluoro-1-iodo-2-methylprop-1-ene |
| PubChem CID | 118348659 |
| Molecular Formula | C4H6FI |
| Molecular Weight | 199.99 g/mol |
| Exact Mass | 199.95 |
| IUPAC Name | 1-fluoro-1-iodo-2-methylprop-1-ene |
| SMILES | CC(C)=C(F)I |
| InChI | InChI=1S/C4H6FI/c1-3(2)4(5)6/h1-2H3 |
| InChIKey | RZRLRUUBESYREQ-UHFFFAOYSA-N |
| XLogP | 2.64 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | |
| Heavy Atoms | 6 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 199.99 |
| LogP ≤ 5 | 2.64 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'iodine', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 1-fluoro-1-iodo-2-methylprop-1-ene?
The IUPAC name of 1-fluoro-1-iodo-2-methylprop-1-ene (CID 118348659) is 1-fluoro-1-iodo-2-methylprop-1-ene.
What is the SMILES notation for 1-fluoro-1-iodo-2-methylprop-1-ene?
The canonical SMILES for 1-fluoro-1-iodo-2-methylprop-1-ene is CC(C)=C(F)I.
What is the InChIKey of 1-fluoro-1-iodo-2-methylprop-1-ene?
The InChIKey is RZRLRUUBESYREQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6FI/c1-3(2)4(5)6/h1-2H3.
What are the key properties of 1-fluoro-1-iodo-2-methylprop-1-ene?
1-fluoro-1-iodo-2-methylprop-1-ene has a molecular weight of 199.99 g/mol, XLogP of 2.64, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-1-iodo-2-methylprop-1-ene is sourced from PubChem (CID 118348659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).