About 9-methyl-9-prop-1-en-2-ylfluorene
9-methyl-9-prop-1-en-2-ylfluorene (PubChem CID 10911089) has the molecular formula C17H16
and a molecular weight of 220.31 g/mol. Its IUPAC name is 9-methyl-9-prop-1-en-2-ylfluorene.
Molecular Properties
| Compound Name | 9-methyl-9-prop-1-en-2-ylfluorene |
| PubChem CID | 10911089 |
| Molecular Formula | C17H16 |
| Molecular Weight | 220.31 g/mol |
| Exact Mass | 220.13 |
| IUPAC Name | 9-methyl-9-prop-1-en-2-ylfluorene |
| SMILES | C=C(C)C1(C)c2ccccc2-c2ccccc21 |
| InChI | InChI=1S/C17H16/c1-12(2)17(3)15-10-6-4-8-13(15)14-9-5-7-11-16(14)17/h4-11H,1H2,2-3H3 |
| InChIKey | QVIFWVQJWLYZAS-UHFFFAOYSA-N |
| XLogP | 4.55 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 1 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 220.31 |
| LogP ≤ 5 | 4.55 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 9-methyl-9-prop-1-en-2-ylfluorene?
The IUPAC name of 9-methyl-9-prop-1-en-2-ylfluorene (CID 10911089) is 9-methyl-9-prop-1-en-2-ylfluorene.
What is the SMILES notation for 9-methyl-9-prop-1-en-2-ylfluorene?
The canonical SMILES for 9-methyl-9-prop-1-en-2-ylfluorene is C=C(C)C1(C)c2ccccc2-c2ccccc21.
What is the InChIKey of 9-methyl-9-prop-1-en-2-ylfluorene?
The InChIKey is QVIFWVQJWLYZAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16/c1-12(2)17(3)15-10-6-4-8-13(15)14-9-5-7-11-16(14)17/h4-11H,1H2,2-3H3.
What are the key properties of 9-methyl-9-prop-1-en-2-ylfluorene?
9-methyl-9-prop-1-en-2-ylfluorene has a molecular weight of 220.31 g/mol, XLogP of 4.55, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-9-prop-1-en-2-ylfluorene is sourced from PubChem (CID 10911089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).