About CID 150789549
CID 150789549 (PubChem CID 150789549) has the molecular formula C22H15F
and a molecular weight of 298.36 g/mol.
Molecular Properties
| Compound Name | CID 150789549 |
| PubChem CID | 150789549 |
| Molecular Formula | C22H15F |
| Molecular Weight | 298.36 g/mol |
| Exact Mass | 298.12 |
| IUPAC Name | — |
| SMILES | Fc1ccc(C(=C=C=Cc2ccccc2)c2ccccc2)cc1 |
| InChI | InChI=1S/C22H15F/c23-21-16-14-20(15-17-21)22(19-11-5-2-6-12-19)13-7-10-18-8-3-1-4-9-18/h1-6,8-12,14-17H/b22-10+ |
| InChIKey | KDOFSQGGQOZJLQ-LSHDLFTRSA-N |
| XLogP | 5.72 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 3 |
| Heavy Atoms | 23 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 298.36 |
| LogP ≤ 5 | 5.72 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
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Frequently Asked Questions
What is the IUPAC name of CID 150789549?
The IUPAC name of CID 150789549 (CID 150789549) is not available.
What is the SMILES notation for CID 150789549?
The canonical SMILES for CID 150789549 is Fc1ccc(C(=C=C=Cc2ccccc2)c2ccccc2)cc1.
What is the InChIKey of CID 150789549?
The InChIKey is KDOFSQGGQOZJLQ-LSHDLFTRSA-N. The full InChI is InChI=1S/C22H15F/c23-21-16-14-20(15-17-21)22(19-11-5-2-6-12-19)13-7-10-18-8-3-1-4-9-18/h1-6,8-12,14-17H/b22-10+.
What are the key properties of CID 150789549?
CID 150789549 has a molecular weight of 298.36 g/mol, XLogP of 5.72, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 150789549 is sourced from PubChem (CID 150789549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).