About 7-(2-phenylphenyl)hept-6-en-2-ol
7-(2-phenylphenyl)hept-6-en-2-ol (PubChem CID 57140283) has the molecular formula C19H22O
and a molecular weight of 266.38 g/mol. Its IUPAC name is 7-(2-phenylphenyl)hept-6-en-2-ol.
Molecular Properties
| Compound Name | 7-(2-phenylphenyl)hept-6-en-2-ol |
| PubChem CID | 57140283 |
| Molecular Formula | C19H22O |
| Molecular Weight | 266.38 g/mol |
| Exact Mass | 266.17 |
| IUPAC Name | 7-(2-phenylphenyl)hept-6-en-2-ol |
| SMILES | CC(O)CCCC=Cc1ccccc1-c1ccccc1 |
| InChI | InChI=1S/C19H22O/c1-16(20)10-4-2-5-11-18-14-8-9-15-19(18)17-12-6-3-7-13-17/h3,5-9,11-16,20H,2,4,10H2,1H3 |
| InChIKey | DZMKMSUTSOVTAC-UHFFFAOYSA-N |
| XLogP | 4.92 |
| TPSA | 20.23 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 266.38 |
| LogP ≤ 5 | 4.92 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 7-(2-phenylphenyl)hept-6-en-2-ol?
The IUPAC name of 7-(2-phenylphenyl)hept-6-en-2-ol (CID 57140283) is 7-(2-phenylphenyl)hept-6-en-2-ol.
What is the SMILES notation for 7-(2-phenylphenyl)hept-6-en-2-ol?
The canonical SMILES for 7-(2-phenylphenyl)hept-6-en-2-ol is CC(O)CCCC=Cc1ccccc1-c1ccccc1.
What is the InChIKey of 7-(2-phenylphenyl)hept-6-en-2-ol?
The InChIKey is DZMKMSUTSOVTAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22O/c1-16(20)10-4-2-5-11-18-14-8-9-15-19(18)17-12-6-3-7-13-17/h3,5-9,11-16,20H,2,4,10H2,1H3.
What are the key properties of 7-(2-phenylphenyl)hept-6-en-2-ol?
7-(2-phenylphenyl)hept-6-en-2-ol has a molecular weight of 266.38 g/mol, XLogP of 4.92, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2-phenylphenyl)hept-6-en-2-ol is sourced from PubChem (CID 57140283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).