About 2-fluoro-1-[(Z)-prop-1-enyl]-4-(trifluoromethyl)benzene
2-fluoro-1-[(Z)-prop-1-enyl]-4-(trifluoromethyl)benzene (PubChem CID 156793075) has the molecular formula C10H8F4
and a molecular weight of 204.17 g/mol. Its IUPAC name is 2-fluoro-1-[(Z)-prop-1-enyl]-4-(trifluoromethyl)benzene.
Molecular Properties
| Compound Name | 2-fluoro-1-[(Z)-prop-1-enyl]-4-(trifluoromethyl)benzene |
| PubChem CID | 156793075 |
| Molecular Formula | C10H8F4 |
| Molecular Weight | 204.17 g/mol |
| Exact Mass | 204.06 |
| IUPAC Name | 2-fluoro-1-[(Z)-prop-1-enyl]-4-(trifluoromethyl)benzene |
| SMILES | C/C=C\c1ccc(C(F)(F)F)cc1F |
| InChI | InChI=1S/C10H8F4/c1-2-3-7-4-5-8(6-9(7)11)10(12,13)14/h2-6H,1H3/b3-2- |
| InChIKey | WAGXSIQXATZKTD-IHWYPQMZSA-N |
| XLogP | 3.88 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 1 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 204.17 |
| LogP ≤ 5 | 3.88 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
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Frequently Asked Questions
What is the IUPAC name of 2-fluoro-1-[(Z)-prop-1-enyl]-4-(trifluoromethyl)benzene?
The IUPAC name of 2-fluoro-1-[(Z)-prop-1-enyl]-4-(trifluoromethyl)benzene (CID 156793075) is 2-fluoro-1-[(Z)-prop-1-enyl]-4-(trifluoromethyl)benzene.
What is the SMILES notation for 2-fluoro-1-[(Z)-prop-1-enyl]-4-(trifluoromethyl)benzene?
The canonical SMILES for 2-fluoro-1-[(Z)-prop-1-enyl]-4-(trifluoromethyl)benzene is C/C=C\c1ccc(C(F)(F)F)cc1F.
What is the InChIKey of 2-fluoro-1-[(Z)-prop-1-enyl]-4-(trifluoromethyl)benzene?
The InChIKey is WAGXSIQXATZKTD-IHWYPQMZSA-N. The full InChI is InChI=1S/C10H8F4/c1-2-3-7-4-5-8(6-9(7)11)10(12,13)14/h2-6H,1H3/b3-2-.
What are the key properties of 2-fluoro-1-[(Z)-prop-1-enyl]-4-(trifluoromethyl)benzene?
2-fluoro-1-[(Z)-prop-1-enyl]-4-(trifluoromethyl)benzene has a molecular weight of 204.17 g/mol, XLogP of 3.88, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-1-[(Z)-prop-1-enyl]-4-(trifluoromethyl)benzene is sourced from PubChem (CID 156793075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).