C265H186Si4 — CID 159902965
2',7'-bis(2,2-diphenylethenyl)-9,9'-spirobi[fluorene];9,10-dinaphthalen-2-ylanthracene;1-(2,2-diphenylethenyl)-4-[4-(2,2-diphenylethenyl)phenyl]benzene;1-[3,5-di(pyren-1-yl)phenyl]pyrene;triphenyl-(3-triphenylsilylphenyl)silane;triphenyl-(4-triphenylsilylphenyl)silane (PubChem CID 159902965) has the molecular formula C265H186Si4 and a molecular weight of 3482.75 g/mol. Its IUPAC name is 2',7'-bis(2,2-diphenylethenyl)-9,9'-spirobi[fluorene];9,10-dinaphthalen-2-ylanthracene;1-(2,2-diphenylethenyl)-4-[4-(2,2-diphenylethenyl)phenyl]benzene;1-[3,5-di(pyren-1-yl)phenyl]pyrene;triphenyl-(3-triphenylsilylphenyl)silane;triphenyl-(4-triphenylsilylphenyl)silane.
| Compound Name | 2',7'-bis(2,2-diphenylethenyl)-9,9'-spirobi[fluorene];9,10-dinaphthalen-2-ylanthracene;1-(2,2-diphenylethenyl)-4-[4-(2,2-diphenylethenyl)phenyl]benzene;1-[3,5-di(pyren-1-yl)phenyl]pyrene;triphenyl-(3-triphenylsilylphenyl)silane;triphenyl-(4-triphenylsilylphenyl)silane |
|---|---|
| PubChem CID | 159902965 |
| Molecular Formula | C265H186Si4 |
| Molecular Weight | 3482.75 g/mol |
| Exact Mass | 3479.36 |
| IUPAC Name | 2',7'-bis(2,2-diphenylethenyl)-9,9'-spirobi[fluorene];9,10-dinaphthalen-2-ylanthracene;1-(2,2-diphenylethenyl)-4-[4-(2,2-diphenylethenyl)phenyl]benzene;1-[3,5-di(pyren-1-yl)phenyl]pyrene;triphenyl-(3-triphenylsilylphenyl)silane;triphenyl-(4-triphenylsilylphenyl)silane |
| SMILES | C(=C(c1ccccc1)c1ccccc1)c1ccc(-c2ccc(C=C(c3ccccc3)c3ccccc3)cc2)cc1.C(=C(c1ccccc1)c1ccccc1)c1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1cc(C=C(c3ccccc3)c3ccccc3)ccc1-2.c1cc2ccc3ccc(-c4cc(-c5ccc6ccc7cccc8ccc5c6c78)cc(-c5ccc6ccc7cccc8ccc5c6c78)c4)c4ccc(c1)c2c34.c1ccc([Si](c2ccccc2)(c2ccccc2)c2ccc([Si](c3ccccc3)(c3ccccc3)c3ccccc3)cc2)cc1.c1ccc([Si](c2ccccc2)(c2ccccc2)c2cccc([Si](c3ccccc3)(c3ccccc3)c3ccccc3)c2)cc1.c1ccc2cc(-c3c4ccccc4c(-c4ccc5ccccc5c4)c4ccccc34)ccc2c1 |
| InChI | InChI=1S/C54H30.C53H36.2C42H34Si2.C40H30.C34H22/c1-4-31-10-13-37-16-22-43(46-25-19-34(7-1)49(31)52(37)46)40-28-41(44-23-17-38-14-11-32-5-2-8-35-20-26-47(44)53(38)50(32)35)30-42(29-40)45-24-18-39-15-12-33-6-3-9-36-21-27-48(45)54(39)51(33)36;1-5-17-39(18-6-1)47(40-19-7-2-8-20-40)33-37-29-31-45-46-32-30-38(34-48(41-21-9-3-10-22-41)42-23-11-4-12-24-42)36-52(46)53(51(45)35-37)49-27-15-13-25-43(49)44-26-14-16-28-50(44)53;1-7-20-35(21-8-1)43(36-22-9-2-10-23-36,37-24-11-3-12-25-37)41-32-19-33-42(34-41)44(38-26-13-4-14-27-38,39-28-15-5-16-29-39)40-30-17-6-18-31-40;1-7-19-35(20-8-1)43(36-21-9-2-10-22-36,37-23-11-3-12-24-37)41-31-33-42(34-32-41)44(38-25-13-4-14-26-38,39-27-15-5-16-28-39)40-29-17-6-18-30-40;1-5-13-35(14-6-1)39(36-15-7-2-8-16-36)29-31-21-25-33(26-22-31)34-27-23-32(24-28-34)30-40(37-17-9-3-10-18-37)38-19-11-4-12-20-38;1-3-11-25-21-27(19-17-23(25)9-1)33-29-13-5-7-15-31(29)34(32-16-8-6-14-30(32)33)28-20-18-24-10-2-4-12-26(24)22-28/h1-30H;1-36H;2*1-34H;1-30H;1-22H |
| InChIKey | NWEUMSUKUXIUQU-UHFFFAOYSA-N |
| XLogP | 57.64 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 34 |
| Heavy Atoms | 269 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3482.75 |
| LogP ≤ 5 | 57.64 |
| 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'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}, {'alert_name': 'stilbene', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'} |
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