About pentakis(butan-1-ol);vanadium
pentakis(butan-1-ol);vanadium (PubChem CID 14228635) has the molecular formula C20H50O5V
and a molecular weight of 421.56 g/mol. Its IUPAC name is pentakis(butan-1-ol);vanadium.
Molecular Properties
| Compound Name | pentakis(butan-1-ol);vanadium |
| PubChem CID | 14228635 |
| Molecular Formula | C20H50O5V |
| Molecular Weight | 421.56 g/mol |
| Exact Mass | 421.31 |
| IUPAC Name | pentakis(butan-1-ol);vanadium |
| SMILES | CCCCO.CCCCO.CCCCO.CCCCO.CCCCO.[V] |
| InChI | InChI=1S/5C4H10O.V/c5*1-2-3-4-5;/h5*5H,2-4H2,1H3; |
| InChIKey | ORSLJWWCPUZDPT-UHFFFAOYSA-N |
| XLogP | 3.89 |
| TPSA | 101.15 Ų |
| H-Bond Donors | 5 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Heavy Atoms | 26 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 421.56 |
| LogP ≤ 5 | 3.89 |
| H-Bond Donors ≤ 5 | 5 |
| H-Bond Acceptors ≤ 10 | 5 |
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Frequently Asked Questions
What is the IUPAC name of pentakis(butan-1-ol);vanadium?
The IUPAC name of pentakis(butan-1-ol);vanadium (CID 14228635) is pentakis(butan-1-ol);vanadium.
What is the SMILES notation for pentakis(butan-1-ol);vanadium?
The canonical SMILES for pentakis(butan-1-ol);vanadium is CCCCO.CCCCO.CCCCO.CCCCO.CCCCO.[V].
What is the InChIKey of pentakis(butan-1-ol);vanadium?
The InChIKey is ORSLJWWCPUZDPT-UHFFFAOYSA-N. The full InChI is InChI=1S/5C4H10O.V/c5*1-2-3-4-5;/h5*5H,2-4H2,1H3;.
What are the key properties of pentakis(butan-1-ol);vanadium?
pentakis(butan-1-ol);vanadium has a molecular weight of 421.56 g/mol, XLogP of 3.89, 10 rotatable bonds, 5 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for pentakis(butan-1-ol);vanadium is sourced from PubChem (CID 14228635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).