About butan-1-ol;cadmium
butan-1-ol;cadmium (PubChem CID 154199105) has the molecular formula C4H10CdO
and a molecular weight of 186.53 g/mol. Its IUPAC name is butan-1-ol;cadmium.
Molecular Properties
| Compound Name | butan-1-ol;cadmium |
| PubChem CID | 154199105 |
| Molecular Formula | C4H10CdO |
| Molecular Weight | 186.53 g/mol |
| Exact Mass | 187.98 |
| IUPAC Name | butan-1-ol;cadmium |
| SMILES | CCCCO.[Cd] |
| InChI | InChI=1S/C4H10O.Cd/c1-2-3-4-5;/h5H,2-4H2,1H3; |
| InChIKey | CKWUAUWXQXISJT-UHFFFAOYSA-N |
| XLogP | 0.78 |
| TPSA | 20.23 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 6 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 186.53 |
| LogP ≤ 5 | 0.78 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of butan-1-ol;cadmium?
The IUPAC name of butan-1-ol;cadmium (CID 154199105) is butan-1-ol;cadmium.
What is the SMILES notation for butan-1-ol;cadmium?
The canonical SMILES for butan-1-ol;cadmium is CCCCO.[Cd].
What is the InChIKey of butan-1-ol;cadmium?
The InChIKey is CKWUAUWXQXISJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10O.Cd/c1-2-3-4-5;/h5H,2-4H2,1H3;.
What are the key properties of butan-1-ol;cadmium?
butan-1-ol;cadmium has a molecular weight of 186.53 g/mol, XLogP of 0.78, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for butan-1-ol;cadmium is sourced from PubChem (CID 154199105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).