About 1-propan-2-yl-2-[(2-propan-2-ylphenyl)methyl]benzene
1-propan-2-yl-2-[(2-propan-2-ylphenyl)methyl]benzene (PubChem CID 15068594) has the molecular formula C19H24
and a molecular weight of 252.40 g/mol. Its IUPAC name is 1-propan-2-yl-2-[(2-propan-2-ylphenyl)methyl]benzene.
Molecular Properties
| Compound Name | 1-propan-2-yl-2-[(2-propan-2-ylphenyl)methyl]benzene |
| PubChem CID | 15068594 |
| Molecular Formula | C19H24 |
| Molecular Weight | 252.40 g/mol |
| Exact Mass | 252.19 |
| IUPAC Name | 1-propan-2-yl-2-[(2-propan-2-ylphenyl)methyl]benzene |
| SMILES | CC(C)c1ccccc1Cc1ccccc1C(C)C |
| InChI | InChI=1S/C19H24/c1-14(2)18-11-7-5-9-16(18)13-17-10-6-8-12-19(17)15(3)4/h5-12,14-15H,13H2,1-4H3 |
| InChIKey | IJPCWGIDOMZYGD-UHFFFAOYSA-N |
| XLogP | 5.52 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 4 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 252.40 |
| LogP ≤ 5 | 5.52 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
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Frequently Asked Questions
What is the IUPAC name of 1-propan-2-yl-2-[(2-propan-2-ylphenyl)methyl]benzene?
The IUPAC name of 1-propan-2-yl-2-[(2-propan-2-ylphenyl)methyl]benzene (CID 15068594) is 1-propan-2-yl-2-[(2-propan-2-ylphenyl)methyl]benzene.
What is the SMILES notation for 1-propan-2-yl-2-[(2-propan-2-ylphenyl)methyl]benzene?
The canonical SMILES for 1-propan-2-yl-2-[(2-propan-2-ylphenyl)methyl]benzene is CC(C)c1ccccc1Cc1ccccc1C(C)C.
What is the InChIKey of 1-propan-2-yl-2-[(2-propan-2-ylphenyl)methyl]benzene?
The InChIKey is IJPCWGIDOMZYGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24/c1-14(2)18-11-7-5-9-16(18)13-17-10-6-8-12-19(17)15(3)4/h5-12,14-15H,13H2,1-4H3.
What are the key properties of 1-propan-2-yl-2-[(2-propan-2-ylphenyl)methyl]benzene?
1-propan-2-yl-2-[(2-propan-2-ylphenyl)methyl]benzene has a molecular weight of 252.40 g/mol, XLogP of 5.52, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propan-2-yl-2-[(2-propan-2-ylphenyl)methyl]benzene is sourced from PubChem (CID 15068594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).