About CID 88509445
CID 88509445 (PubChem CID 88509445) has the molecular formula C27H42Ge2O
and a molecular weight of 527.85 g/mol.
Molecular Properties
| Compound Name | CID 88509445 |
| PubChem CID | 88509445 |
| Molecular Formula | C27H42Ge2O |
| Molecular Weight | 527.85 g/mol |
| Exact Mass | 530.17 |
| IUPAC Name | — |
| SMILES | CCC[Ge](CCC)CCC(O[Ge](CCC)CCC)(c1ccccc1)c1ccccc1 |
| InChI | InChI=1S/C27H42Ge2O/c1-5-20-28(21-6-2)24-19-27(25-15-11-9-12-16-25,26-17-13-10-14-18-26)30-29(22-7-3)23-8-4/h9-18H,5-8,19-24H2,1-4H3 |
| InChIKey | QZUZWKJNPGJBGF-UHFFFAOYSA-N |
| XLogP | 8.46 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 15 |
| Heavy Atoms | 30 |
| Complexity | — |
Lipinski Rule of Five
2 violations
| Rule | Value |
| MW ≤ 500 | 527.85 |
| LogP ≤ 5 | 8.46 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of CID 88509445?
The IUPAC name of CID 88509445 (CID 88509445) is not available.
What is the SMILES notation for CID 88509445?
The canonical SMILES for CID 88509445 is CCC[Ge](CCC)CCC(O[Ge](CCC)CCC)(c1ccccc1)c1ccccc1.
What is the InChIKey of CID 88509445?
The InChIKey is QZUZWKJNPGJBGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H42Ge2O/c1-5-20-28(21-6-2)24-19-27(25-15-11-9-12-16-25,26-17-13-10-14-18-26)30-29(22-7-3)23-8-4/h9-18H,5-8,19-24H2,1-4H3.
What are the key properties of CID 88509445?
CID 88509445 has a molecular weight of 527.85 g/mol, XLogP of 8.46, 15 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 88509445 is sourced from PubChem (CID 88509445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).