C143H122Si2 — CID 159711490
2,6-ditert-butyl-9-naphthalen-1-yl-10-phenylanthracene;2,6-dimethyl-9-naphthalen-1-yl-10-phenylanthracene;2-methyl-10-naphthalen-2-yl-9-(4-phenylphenyl)anthracene;trimethyl-(9-naphthalen-1-yl-10-phenyl-6-trimethylsilylanthracen-2-yl)silane (PubChem CID 159711490) has the molecular formula C143H122Si2 and a molecular weight of 1896.72 g/mol. Its IUPAC name is 2,6-ditert-butyl-9-naphthalen-1-yl-10-phenylanthracene;2,6-dimethyl-9-naphthalen-1-yl-10-phenylanthracene;2-methyl-10-naphthalen-2-yl-9-(4-phenylphenyl)anthracene;trimethyl-(9-naphthalen-1-yl-10-phenyl-6-trimethylsilylanthracen-2-yl)silane.
| Compound Name | 2,6-ditert-butyl-9-naphthalen-1-yl-10-phenylanthracene;2,6-dimethyl-9-naphthalen-1-yl-10-phenylanthracene;2-methyl-10-naphthalen-2-yl-9-(4-phenylphenyl)anthracene;trimethyl-(9-naphthalen-1-yl-10-phenyl-6-trimethylsilylanthracen-2-yl)silane |
|---|---|
| PubChem CID | 159711490 |
| Molecular Formula | C143H122Si2 |
| Molecular Weight | 1896.72 g/mol |
| Exact Mass | 1894.91 |
| IUPAC Name | 2,6-ditert-butyl-9-naphthalen-1-yl-10-phenylanthracene;2,6-dimethyl-9-naphthalen-1-yl-10-phenylanthracene;2-methyl-10-naphthalen-2-yl-9-(4-phenylphenyl)anthracene;trimethyl-(9-naphthalen-1-yl-10-phenyl-6-trimethylsilylanthracen-2-yl)silane |
| SMILES | CC(C)(C)c1ccc2c(-c3cccc4ccccc34)c3cc(C(C)(C)C)ccc3c(-c3ccccc3)c2c1.C[Si](C)(C)c1ccc2c(-c3cccc4ccccc34)c3cc([Si](C)(C)C)ccc3c(-c3ccccc3)c2c1.Cc1ccc2c(-c3ccc4ccccc4c3)c3ccccc3c(-c3ccc(-c4ccccc4)cc3)c2c1.Cc1ccc2c(-c3cccc4ccccc34)c3cc(C)ccc3c(-c3ccccc3)c2c1 |
| InChI | InChI=1S/C38H36.C37H26.C36H36Si2.C32H24/c1-37(2,3)27-20-22-32-33(23-27)35(26-14-8-7-9-15-26)31-21-19-28(38(4,5)6)24-34(31)36(32)30-18-12-16-25-13-10-11-17-29(25)30;1-25-15-22-34-35(23-25)36(29-19-16-28(17-20-29)26-9-3-2-4-10-26)32-13-7-8-14-33(32)37(34)31-21-18-27-11-5-6-12-30(27)24-31;1-37(2,3)27-20-22-32-33(23-27)35(26-14-8-7-9-15-26)31-21-19-28(38(4,5)6)24-34(31)36(32)30-18-12-16-25-13-10-11-17-29(25)30;1-21-16-18-28-29(19-21)31(24-10-4-3-5-11-24)27-17-15-22(2)20-30(27)32(28)26-14-8-12-23-9-6-7-13-25(23)26/h7-24H,1-6H3;2-24H,1H3;7-24H,1-6H3;3-20H,1-2H3 |
| InChIKey | MYWYCYFDNCRGLB-UHFFFAOYSA-N |
| XLogP | 40.20 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 11 |
| Heavy Atoms | 145 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 1896.72 |
| LogP ≤ 5 | 40.20 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'} |
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