C311H244 — CID 160983481
9-[9,9-bis(2-methylpropyl)fluoren-2-yl]-10-[4-(3,5-diphenylphenyl)naphthalen-1-yl]anthracene;9-(9-butyl-9-tert-butylfluoren-2-yl)-10-[4-(3,5-diphenylphenyl)naphthalen-1-yl]anthracene;9-(9-tert-butyl-9-propan-2-ylfluoren-2-yl)-10-[4-(3,5-diphenylphenyl)naphthalen-1-yl]anthracene;9-(9-tert-butyl-9-propylfluoren-2-yl)-10-[4-(3,5-diphenylphenyl)naphthalen-1-yl]anthracene;9-[4-(3,5-diphenylphenyl)naphthalen-1-yl]-10-(9-phenyl-9H-fluoren-2-yl)anthracene (PubChem CID 160983481) has the molecular formula C311H244 and a molecular weight of 3981.37 g/mol. Its IUPAC name is 9-[9,9-bis(2-methylpropyl)fluoren-2-yl]-10-[4-(3,5-diphenylphenyl)naphthalen-1-yl]anthracene;9-(9-butyl-9-tert-butylfluoren-2-yl)-10-[4-(3,5-diphenylphenyl)naphthalen-1-yl]anthracene;9-(9-tert-butyl-9-propan-2-ylfluoren-2-yl)-10-[4-(3,5-diphenylphenyl)naphthalen-1-yl]anthracene;9-(9-tert-butyl-9-propylfluoren-2-yl)-10-[4-(3,5-diphenylphenyl)naphthalen-1-yl]anthracene;9-[4-(3,5-diphenylphenyl)naphthalen-1-yl]-10-(9-phenyl-9H-fluoren-2-yl)anthracene.
| Compound Name | 9-[9,9-bis(2-methylpropyl)fluoren-2-yl]-10-[4-(3,5-diphenylphenyl)naphthalen-1-yl]anthracene;9-(9-butyl-9-tert-butylfluoren-2-yl)-10-[4-(3,5-diphenylphenyl)naphthalen-1-yl]anthracene;9-(9-tert-butyl-9-propan-2-ylfluoren-2-yl)-10-[4-(3,5-diphenylphenyl)naphthalen-1-yl]anthracene;9-(9-tert-butyl-9-propylfluoren-2-yl)-10-[4-(3,5-diphenylphenyl)naphthalen-1-yl]anthracene;9-[4-(3,5-diphenylphenyl)naphthalen-1-yl]-10-(9-phenyl-9H-fluoren-2-yl)anthracene |
|---|---|
| PubChem CID | 160983481 |
| Molecular Formula | C311H244 |
| Molecular Weight | 3981.37 g/mol |
| Exact Mass | 3977.91 |
| IUPAC Name | 9-[9,9-bis(2-methylpropyl)fluoren-2-yl]-10-[4-(3,5-diphenylphenyl)naphthalen-1-yl]anthracene;9-(9-butyl-9-tert-butylfluoren-2-yl)-10-[4-(3,5-diphenylphenyl)naphthalen-1-yl]anthracene;9-(9-tert-butyl-9-propan-2-ylfluoren-2-yl)-10-[4-(3,5-diphenylphenyl)naphthalen-1-yl]anthracene;9-(9-tert-butyl-9-propylfluoren-2-yl)-10-[4-(3,5-diphenylphenyl)naphthalen-1-yl]anthracene;9-[4-(3,5-diphenylphenyl)naphthalen-1-yl]-10-(9-phenyl-9H-fluoren-2-yl)anthracene |
| SMILES | CC(C)C1(C(C)(C)C)c2ccccc2-c2ccc(-c3c4ccccc4c(-c4ccc(-c5cc(-c6ccccc6)cc(-c6ccccc6)c5)c5ccccc45)c4ccccc34)cc21.CC(C)CC1(CC(C)C)c2ccccc2-c2ccc(-c3c4ccccc4c(-c4ccc(-c5cc(-c6ccccc6)cc(-c6ccccc6)c5)c5ccccc45)c4ccccc34)cc21.CCCC1(C(C)(C)C)c2ccccc2-c2ccc(-c3c4ccccc4c(-c4ccc(-c5cc(-c6ccccc6)cc(-c6ccccc6)c5)c5ccccc45)c4ccccc34)cc21.CCCCC1(C(C)(C)C)c2ccccc2-c2ccc(-c3c4ccccc4c(-c4ccc(-c5cc(-c6ccccc6)cc(-c6ccccc6)c5)c5ccccc45)c4ccccc34)cc21.c1ccc(-c2cc(-c3ccccc3)cc(-c3ccc(-c4c5ccccc5c(-c5ccc6c(c5)C(c5ccccc5)c5ccccc5-6)c5ccccc45)c4ccccc34)c2)cc1 |
| InChI | InChI=1S/2C63H52.2C62H50.C61H40/c1-41(2)39-63(40-42(3)4)59-30-18-17-25-52(59)53-32-31-45(38-60(53)63)61-54-26-13-15-28-56(54)62(57-29-16-14-27-55(57)61)58-34-33-49(50-23-11-12-24-51(50)58)48-36-46(43-19-7-5-8-20-43)35-47(37-48)44-21-9-6-10-22-44;1-5-6-37-63(62(2,3)4)58-32-20-19-27-51(58)52-34-33-44(41-59(52)63)60-53-28-15-17-30-55(53)61(56-31-18-16-29-54(56)60)57-36-35-48(49-25-13-14-26-50(49)57)47-39-45(42-21-9-7-10-22-42)38-46(40-47)43-23-11-8-12-24-43;1-40(2)62(61(3,4)5)57-31-19-18-26-50(57)51-33-32-43(39-58(51)62)59-52-27-14-16-29-54(52)60(55-30-17-15-28-53(55)59)56-35-34-47(48-24-12-13-25-49(48)56)46-37-44(41-20-8-6-9-21-41)36-45(38-46)42-22-10-7-11-23-42;1-5-36-62(61(2,3)4)57-31-19-18-26-50(57)51-33-32-43(40-58(51)62)59-52-27-14-16-29-54(52)60(55-30-17-15-28-53(55)59)56-35-34-47(48-24-12-13-25-49(48)56)46-38-44(41-20-8-6-9-21-41)37-45(39-46)42-22-10-7-11-23-42;1-4-18-40(19-5-1)44-36-45(41-20-6-2-7-21-41)38-46(37-44)47-34-35-57(49-25-11-10-24-48(47)49)61-55-30-16-14-28-53(55)60(54-29-15-17-31-56(54)61)43-32-33-51-50-26-12-13-27-52(50)59(58(51)39-43)42-22-8-3-9-23-42/h5-38,41-42H,39-40H2,1-4H3;7-36,38-41H,5-6,37H2,1-4H3;6-40H,1-5H3;6-35,37-40H,5,36H2,1-4H3;1-39,59H |
| InChIKey | SZUVXXQUORZEFQ-UHFFFAOYSA-N |
| XLogP | 87.51 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 36 |
| Heavy Atoms | 311 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3981.37 |
| LogP ≤ 5 | 87.51 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |