About 1-[[4-(cyclohexen-1-yl)phenyl]methyl]cyclohexan-1-ol
1-[[4-(cyclohexen-1-yl)phenyl]methyl]cyclohexan-1-ol (PubChem CID 101241900) has the molecular formula C19H26O
and a molecular weight of 270.42 g/mol. Its IUPAC name is 1-[[4-(cyclohexen-1-yl)phenyl]methyl]cyclohexan-1-ol.
Molecular Properties
| Compound Name | 1-[[4-(cyclohexen-1-yl)phenyl]methyl]cyclohexan-1-ol |
| PubChem CID | 101241900 |
| Molecular Formula | C19H26O |
| Molecular Weight | 270.42 g/mol |
| Exact Mass | 270.20 |
| IUPAC Name | 1-[[4-(cyclohexen-1-yl)phenyl]methyl]cyclohexan-1-ol |
| SMILES | OC1(Cc2ccc(C3=CCCCC3)cc2)CCCCC1 |
| InChI | InChI=1S/C19H26O/c20-19(13-5-2-6-14-19)15-16-9-11-18(12-10-16)17-7-3-1-4-8-17/h7,9-12,20H,1-6,8,13-15H2 |
| InChIKey | SNOWPOFQHXETIF-UHFFFAOYSA-N |
| XLogP | 4.88 |
| TPSA | 20.23 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 270.42 |
| LogP ≤ 5 | 4.88 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of 1-[[4-(cyclohexen-1-yl)phenyl]methyl]cyclohexan-1-ol?
The IUPAC name of 1-[[4-(cyclohexen-1-yl)phenyl]methyl]cyclohexan-1-ol (CID 101241900) is 1-[[4-(cyclohexen-1-yl)phenyl]methyl]cyclohexan-1-ol.
What is the SMILES notation for 1-[[4-(cyclohexen-1-yl)phenyl]methyl]cyclohexan-1-ol?
The canonical SMILES for 1-[[4-(cyclohexen-1-yl)phenyl]methyl]cyclohexan-1-ol is OC1(Cc2ccc(C3=CCCCC3)cc2)CCCCC1.
What is the InChIKey of 1-[[4-(cyclohexen-1-yl)phenyl]methyl]cyclohexan-1-ol?
The InChIKey is SNOWPOFQHXETIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26O/c20-19(13-5-2-6-14-19)15-16-9-11-18(12-10-16)17-7-3-1-4-8-17/h7,9-12,20H,1-6,8,13-15H2.
What are the key properties of 1-[[4-(cyclohexen-1-yl)phenyl]methyl]cyclohexan-1-ol?
1-[[4-(cyclohexen-1-yl)phenyl]methyl]cyclohexan-1-ol has a molecular weight of 270.42 g/mol, XLogP of 4.88, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[4-(cyclohexen-1-yl)phenyl]methyl]cyclohexan-1-ol is sourced from PubChem (CID 101241900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).