C283H190 — CID 157278210
9-[9,9-bis(3-phenylphenyl)fluoren-2-yl]-10-[4-(3,5-diphenylphenyl)naphthalen-1-yl]anthracene;9-[4-(3,5-diphenylphenyl)naphthalen-1-yl]-10-[9-ethyl-9-(2-phenylphenyl)fluoren-2-yl]anthracene;9-[4-(3,5-diphenylphenyl)naphthalen-1-yl]-10-[9-methyl-9-(2-phenylphenyl)fluoren-2-yl]anthracene;9-[4-(3,5-diphenylphenyl)naphthalen-1-yl]-10-[9-(2-phenylphenyl)-9H-fluoren-2-yl]anthracene (PubChem CID 157278210) has the molecular formula C283H190 and a molecular weight of 3590.63 g/mol. Its IUPAC name is 9-[9,9-bis(3-phenylphenyl)fluoren-2-yl]-10-[4-(3,5-diphenylphenyl)naphthalen-1-yl]anthracene;9-[4-(3,5-diphenylphenyl)naphthalen-1-yl]-10-[9-ethyl-9-(2-phenylphenyl)fluoren-2-yl]anthracene;9-[4-(3,5-diphenylphenyl)naphthalen-1-yl]-10-[9-methyl-9-(2-phenylphenyl)fluoren-2-yl]anthracene;9-[4-(3,5-diphenylphenyl)naphthalen-1-yl]-10-[9-(2-phenylphenyl)-9H-fluoren-2-yl]anthracene.
| Compound Name | 9-[9,9-bis(3-phenylphenyl)fluoren-2-yl]-10-[4-(3,5-diphenylphenyl)naphthalen-1-yl]anthracene;9-[4-(3,5-diphenylphenyl)naphthalen-1-yl]-10-[9-ethyl-9-(2-phenylphenyl)fluoren-2-yl]anthracene;9-[4-(3,5-diphenylphenyl)naphthalen-1-yl]-10-[9-methyl-9-(2-phenylphenyl)fluoren-2-yl]anthracene;9-[4-(3,5-diphenylphenyl)naphthalen-1-yl]-10-[9-(2-phenylphenyl)-9H-fluoren-2-yl]anthracene |
|---|---|
| PubChem CID | 157278210 |
| Molecular Formula | C283H190 |
| Molecular Weight | 3590.63 g/mol |
| Exact Mass | 3587.49 |
| IUPAC Name | 9-[9,9-bis(3-phenylphenyl)fluoren-2-yl]-10-[4-(3,5-diphenylphenyl)naphthalen-1-yl]anthracene;9-[4-(3,5-diphenylphenyl)naphthalen-1-yl]-10-[9-ethyl-9-(2-phenylphenyl)fluoren-2-yl]anthracene;9-[4-(3,5-diphenylphenyl)naphthalen-1-yl]-10-[9-methyl-9-(2-phenylphenyl)fluoren-2-yl]anthracene;9-[4-(3,5-diphenylphenyl)naphthalen-1-yl]-10-[9-(2-phenylphenyl)-9H-fluoren-2-yl]anthracene |
| SMILES | CC1(c2ccccc2-c2ccccc2)c2ccccc2-c2ccc(-c3c4ccccc4c(-c4ccc(-c5cc(-c6ccccc6)cc(-c6ccccc6)c5)c5ccccc45)c4ccccc34)cc21.CCC1(c2ccccc2-c2ccccc2)c2ccccc2-c2ccc(-c3c4ccccc4c(-c4ccc(-c5cc(-c6ccccc6)cc(-c6ccccc6)c5)c5ccccc45)c4ccccc34)cc21.c1ccc(-c2cc(-c3ccccc3)cc(-c3ccc(-c4c5ccccc5c(-c5ccc6c(c5)C(c5cccc(-c7ccccc7)c5)(c5cccc(-c7ccccc7)c5)c5ccccc5-6)c5ccccc45)c4ccccc34)c2)cc1.c1ccc(-c2cc(-c3ccccc3)cc(-c3ccc(-c4c5ccccc5c(-c5ccc6c(c5)C(c5ccccc5-c5ccccc5)c5ccccc5-6)c5ccccc45)c4ccccc34)c2)cc1 |
| InChI | InChI=1S/C79H52.C69H48.C68H46.C67H44/c1-5-23-53(24-6-1)57-31-21-33-63(50-57)79(64-34-22-32-58(51-64)54-25-7-2-8-26-54)75-42-20-19-37-68(75)69-44-43-59(52-76(69)79)77-70-38-15-17-40-72(70)78(73-41-18-16-39-71(73)77)74-46-45-65(66-35-13-14-36-67(66)74)62-48-60(55-27-9-3-10-28-55)47-61(49-62)56-29-11-4-12-30-56;1-2-69(64-36-20-18-28-54(64)48-26-10-5-11-27-48)65-37-21-19-31-57(65)58-39-38-49(45-66(58)69)67-59-32-14-16-34-61(59)68(62-35-17-15-33-60(62)67)63-41-40-53(55-29-12-13-30-56(55)63)52-43-50(46-22-6-3-7-23-46)42-51(44-52)47-24-8-4-9-25-47;1-68(63-35-19-17-27-53(63)47-25-9-4-10-26-47)64-36-20-18-30-56(64)57-38-37-48(44-65(57)68)66-58-31-13-15-33-60(58)67(61-34-16-14-32-59(61)66)62-40-39-52(54-28-11-12-29-55(54)62)51-42-49(45-21-5-2-6-22-45)41-50(43-51)46-23-7-3-8-24-46;1-4-20-44(21-5-1)48-40-49(45-22-6-2-7-23-45)42-50(41-48)52-38-39-63(54-28-12-11-27-53(52)54)66-61-34-18-16-32-59(61)65(60-33-17-19-35-62(60)66)47-36-37-56-55-29-13-15-31-58(55)67(64(56)43-47)57-30-14-10-26-51(57)46-24-8-3-9-25-46/h1-52H;3-45H,2H2,1H3;2-44H,1H3;1-43,67H |
| InChIKey | AZIUOLPIJVOLIO-UHFFFAOYSA-N |
| XLogP | 76.84 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 31 |
| Heavy Atoms | 283 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3590.63 |
| LogP ≤ 5 | 76.84 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
| Structural Alerts | {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'} |
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