About 2-methyl-4-(4-methylphenyl)-1-phenylnaphthalene
2-methyl-4-(4-methylphenyl)-1-phenylnaphthalene (PubChem CID 46919083) has the molecular formula C24H20
and a molecular weight of 308.42 g/mol. Its IUPAC name is 2-methyl-4-(4-methylphenyl)-1-phenylnaphthalene.
Molecular Properties
| Compound Name | 2-methyl-4-(4-methylphenyl)-1-phenylnaphthalene |
| PubChem CID | 46919083 |
| Molecular Formula | C24H20 |
| Molecular Weight | 308.42 g/mol |
| Exact Mass | 308.16 |
| IUPAC Name | 2-methyl-4-(4-methylphenyl)-1-phenylnaphthalene |
| SMILES | Cc1ccc(-c2cc(C)c(-c3ccccc3)c3ccccc23)cc1 |
| InChI | InChI=1S/C24H20/c1-17-12-14-19(15-13-17)23-16-18(2)24(20-8-4-3-5-9-20)22-11-7-6-10-21(22)23/h3-16H,1-2H3 |
| InChIKey | NPVMZRVQLACTMQ-UHFFFAOYSA-N |
| XLogP | 6.79 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 2 |
| Heavy Atoms | 24 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 308.42 |
| LogP ≤ 5 | 6.79 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
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Frequently Asked Questions
What is the IUPAC name of 2-methyl-4-(4-methylphenyl)-1-phenylnaphthalene?
The IUPAC name of 2-methyl-4-(4-methylphenyl)-1-phenylnaphthalene (CID 46919083) is 2-methyl-4-(4-methylphenyl)-1-phenylnaphthalene.
What is the SMILES notation for 2-methyl-4-(4-methylphenyl)-1-phenylnaphthalene?
The canonical SMILES for 2-methyl-4-(4-methylphenyl)-1-phenylnaphthalene is Cc1ccc(-c2cc(C)c(-c3ccccc3)c3ccccc23)cc1.
What is the InChIKey of 2-methyl-4-(4-methylphenyl)-1-phenylnaphthalene?
The InChIKey is NPVMZRVQLACTMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20/c1-17-12-14-19(15-13-17)23-16-18(2)24(20-8-4-3-5-9-20)22-11-7-6-10-21(22)23/h3-16H,1-2H3.
What are the key properties of 2-methyl-4-(4-methylphenyl)-1-phenylnaphthalene?
2-methyl-4-(4-methylphenyl)-1-phenylnaphthalene has a molecular weight of 308.42 g/mol, XLogP of 6.79, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-(4-methylphenyl)-1-phenylnaphthalene is sourced from PubChem (CID 46919083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).