About 4-(2-cyclohexylpropan-2-yl)cyclohexan-1-ol
4-(2-cyclohexylpropan-2-yl)cyclohexan-1-ol (PubChem CID 19694020) has the molecular formula C15H28O
and a molecular weight of 224.39 g/mol. Its IUPAC name is 4-(2-cyclohexylpropan-2-yl)cyclohexan-1-ol.
Molecular Properties
| Compound Name | 4-(2-cyclohexylpropan-2-yl)cyclohexan-1-ol |
| PubChem CID | 19694020 |
| Molecular Formula | C15H28O |
| Molecular Weight | 224.39 g/mol |
| Exact Mass | 224.21 |
| IUPAC Name | 4-(2-cyclohexylpropan-2-yl)cyclohexan-1-ol |
| SMILES | CC(C)(C1CCCCC1)C1CCC(O)CC1 |
| InChI | InChI=1S/C15H28O/c1-15(2,12-6-4-3-5-7-12)13-8-10-14(16)11-9-13/h12-14,16H,3-11H2,1-2H3 |
| InChIKey | SOEDCPFFUZMBNX-UHFFFAOYSA-N |
| XLogP | 4.14 |
| TPSA | 20.23 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 224.39 |
| LogP ≤ 5 | 4.14 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of 4-(2-cyclohexylpropan-2-yl)cyclohexan-1-ol?
The IUPAC name of 4-(2-cyclohexylpropan-2-yl)cyclohexan-1-ol (CID 19694020) is 4-(2-cyclohexylpropan-2-yl)cyclohexan-1-ol.
What is the SMILES notation for 4-(2-cyclohexylpropan-2-yl)cyclohexan-1-ol?
The canonical SMILES for 4-(2-cyclohexylpropan-2-yl)cyclohexan-1-ol is CC(C)(C1CCCCC1)C1CCC(O)CC1.
What is the InChIKey of 4-(2-cyclohexylpropan-2-yl)cyclohexan-1-ol?
The InChIKey is SOEDCPFFUZMBNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28O/c1-15(2,12-6-4-3-5-7-12)13-8-10-14(16)11-9-13/h12-14,16H,3-11H2,1-2H3.
What are the key properties of 4-(2-cyclohexylpropan-2-yl)cyclohexan-1-ol?
4-(2-cyclohexylpropan-2-yl)cyclohexan-1-ol has a molecular weight of 224.39 g/mol, XLogP of 4.14, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-cyclohexylpropan-2-yl)cyclohexan-1-ol is sourced from PubChem (CID 19694020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).