About CID 20789201
CID 20789201 (PubChem CID 20789201) has the molecular formula C8H18Al-
and a molecular weight of 141.21 g/mol.
Molecular Properties
| Compound Name | CID 20789201 |
| PubChem CID | 20789201 |
| Molecular Formula | C8H18Al- |
| Molecular Weight | 141.21 g/mol |
| Exact Mass | 141.12 |
| IUPAC Name | — |
| SMILES | CC(C)C[Al-]CC(C)C |
| InChI | InChI=1S/2C4H9.Al/c2*1-4(2)3;/h2*4H,1H2,2-3H3;/q;;-1 |
| InChIKey | JBYPAJTYHHBBDX-UHFFFAOYSA-N |
| XLogP | 2.84 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 4 |
| Heavy Atoms | 9 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 141.21 |
| LogP ≤ 5 | 2.84 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
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Frequently Asked Questions
What is the IUPAC name of CID 20789201?
The IUPAC name of CID 20789201 (CID 20789201) is not available.
What is the SMILES notation for CID 20789201?
The canonical SMILES for CID 20789201 is CC(C)C[Al-]CC(C)C.
What is the InChIKey of CID 20789201?
The InChIKey is JBYPAJTYHHBBDX-UHFFFAOYSA-N. The full InChI is InChI=1S/2C4H9.Al/c2*1-4(2)3;/h2*4H,1H2,2-3H3;/q;;-1.
What are the key properties of CID 20789201?
CID 20789201 has a molecular weight of 141.21 g/mol, XLogP of 2.84, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 20789201 is sourced from PubChem (CID 20789201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).