About CID 10801751
CID 10801751 (PubChem CID 10801751) has the molecular formula C18H15Cl
and a molecular weight of 266.77 g/mol.
Molecular Properties
| Compound Name | CID 10801751 |
| PubChem CID | 10801751 |
| Molecular Formula | C18H15Cl |
| Molecular Weight | 266.77 g/mol |
| Exact Mass | 266.09 |
| IUPAC Name | — |
| SMILES | Clc1ccc(C(=C2[CH]CC[CH]2)c2ccccc2)cc1 |
| InChI | InChI=1S/C18H15Cl/c19-17-12-10-16(11-13-17)18(15-8-4-5-9-15)14-6-2-1-3-7-14/h1-3,6-13H,4-5H2 |
| InChIKey | WOFWAQTZRGULRI-UHFFFAOYSA-N |
| XLogP | 5.34 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 2 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 266.77 |
| LogP ≤ 5 | 5.34 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
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Frequently Asked Questions
What is the IUPAC name of CID 10801751?
The IUPAC name of CID 10801751 (CID 10801751) is not available.
What is the SMILES notation for CID 10801751?
The canonical SMILES for CID 10801751 is Clc1ccc(C(=C2[CH]CC[CH]2)c2ccccc2)cc1.
What is the InChIKey of CID 10801751?
The InChIKey is WOFWAQTZRGULRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15Cl/c19-17-12-10-16(11-13-17)18(15-8-4-5-9-15)14-6-2-1-3-7-14/h1-3,6-13H,4-5H2.
What are the key properties of CID 10801751?
CID 10801751 has a molecular weight of 266.77 g/mol, XLogP of 5.34, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 10801751 is sourced from PubChem (CID 10801751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).