About cyclopropyl-[4-(4-methylphenyl)phenyl]methanol
cyclopropyl-[4-(4-methylphenyl)phenyl]methanol (PubChem CID 175668827) has the molecular formula C17H18O
and a molecular weight of 238.33 g/mol. Its IUPAC name is cyclopropyl-[4-(4-methylphenyl)phenyl]methanol.
Molecular Properties
| Compound Name | cyclopropyl-[4-(4-methylphenyl)phenyl]methanol |
| PubChem CID | 175668827 |
| Molecular Formula | C17H18O |
| Molecular Weight | 238.33 g/mol |
| Exact Mass | 238.14 |
| IUPAC Name | cyclopropyl-[4-(4-methylphenyl)phenyl]methanol |
| SMILES | Cc1ccc(-c2ccc(C(O)C3CC3)cc2)cc1 |
| InChI | InChI=1S/C17H18O/c1-12-2-4-13(5-3-12)14-6-8-15(9-7-14)17(18)16-10-11-16/h2-9,16-18H,10-11H2,1H3 |
| InChIKey | DVIONMFSKIZWIS-UHFFFAOYSA-N |
| XLogP | 4.11 |
| TPSA | 20.23 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 238.33 |
| LogP ≤ 5 | 4.11 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of cyclopropyl-[4-(4-methylphenyl)phenyl]methanol?
The IUPAC name of cyclopropyl-[4-(4-methylphenyl)phenyl]methanol (CID 175668827) is cyclopropyl-[4-(4-methylphenyl)phenyl]methanol.
What is the SMILES notation for cyclopropyl-[4-(4-methylphenyl)phenyl]methanol?
The canonical SMILES for cyclopropyl-[4-(4-methylphenyl)phenyl]methanol is Cc1ccc(-c2ccc(C(O)C3CC3)cc2)cc1.
What is the InChIKey of cyclopropyl-[4-(4-methylphenyl)phenyl]methanol?
The InChIKey is DVIONMFSKIZWIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18O/c1-12-2-4-13(5-3-12)14-6-8-15(9-7-14)17(18)16-10-11-16/h2-9,16-18H,10-11H2,1H3.
What are the key properties of cyclopropyl-[4-(4-methylphenyl)phenyl]methanol?
cyclopropyl-[4-(4-methylphenyl)phenyl]methanol has a molecular weight of 238.33 g/mol, XLogP of 4.11, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-[4-(4-methylphenyl)phenyl]methanol is sourced from PubChem (CID 175668827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).